585557-33-1
2-[[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2-ISOPROPYLPHENYL)ACETAMIDE
Name
2-[[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2-ISOPROPYLPHENYL)ACETAMIDE
Formula
C21 H23 N5 O S
MolWeight
393.513
1Identification
【Name】
2-[[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2-ISOPROPYLPHENYL)ACETAMIDE
【CAS】
【MDL】
MFCD04030552
【English Synonyms】
【Formula】
C21 H23 N5 O S
【MolWeight】
393.513
【Inchi】
InChI=1S/C21H23N5OS/c1-4-13-26-20(18-11-7-8-12-22-18)24-25-21(26)28-14-19(27)23-17-10-6-5-9-16(17)15(2)3/h4-12,15H,1,13-14H2,2-3H3,(H,23,27)
【InChIKey】
InChIKey=YKRFHIUPJPCIPF-UHFFFAOYSA-N
【SMILES】
CC(C)c1ccccc1NC(=O)CSc2nnc(n2CC=C)c3ccccn3
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-[[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]-N-(2-ISOPROPYLPHENYL)ACETAMIDE.cml
Quick Release
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TOP Suppliers
Sigma-Aldrich Corporation
Catalog No:L415359-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 585557-33-1 Suppliers>>
Catalog No:L415359-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 585557-33-1 Suppliers>>
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