586988-05-8
4-(((4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)METHYL)BENZONITRILE
Name
4-(((4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)METHYL)BENZONITRILE
Formula
C18 H15 N5 S
MolWeight
333.418
1Identification
【Name】
4-(((4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)METHYL)BENZONITRILE
【CAS】
【MDL】
MFCD04031106
【English Synonyms】
【Formula】
C18 H15 N5 S
【MolWeight】
333.418
【Inchi】
InChI=1S/C18H15N5S/c1-2-11-23-17(16-5-3-4-10-20-16)21-22-18(23)24-13-15-8-6-14(12-19)7-9-15/h2-10H,1,11,13H2
【InChIKey】
InChIKey=IGQCBPAVJCDVGM-UHFFFAOYSA-N
【SMILES】
C=CCn1c(nnc1SCc2ccc(cc2)C#N)c3ccccn3
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(((4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)METHYL)BENZONITRILE.cml
Quick Release
2-[2-(FURAN-2-YL)-1,3-THIAZOL-4-YL]-1-PHENYLETHAN-1-ONE
3-AMINO-N-(3,4-DIHYDRO-2H-1-BENZOPYRAN-4-YL)-2-METHYLPROPANAMIDE
2-(2-AMINO-1H-1,3-BENZODIAZOL-1-YL)CYCLOHEXAN-1-OL
(1-[5-BROMO-2-(OXOLAN-2-YLMETHOXY)PHENYL]ETHYL)(ETHYL)AMINE
5-BROMO-6-[BROMO(PHENYL)METHYL]-2,3-DIHYDRO-1H-1,3-BENZODIAZOL-2-ONE
ETHYL 2-[(3-METHYLQUINOXALIN-2-YL)AMINO]PROPANOATE
TOP Suppliers
Sigma-Aldrich Corporation
Catalog No:L415219-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 586988-05-8 Suppliers>>
Catalog No:L415219-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 586988-05-8 Suppliers>>
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