539810-99-6
N-(2,5-DIMETHYLPHENYL)-N'-(3-METHYL-5-THIOXO-1,5-DIHYDRO-4H-1,2,4-TRIAZOL-4-YL)THIOUREA
Name
N-(2,5-DIMETHYLPHENYL)-N'-(3-METHYL-5-THIOXO-1,5-DIHYDRO-4H-1,2,4-TRIAZOL-4-YL)THIOUREA
Formula
C12 H15 N5 S2
MolWeight
293.418
1Identification
【Name】
N-(2,5-DIMETHYLPHENYL)-N'-(3-METHYL-5-THIOXO-1,5-DIHYDRO-4H-1,2,4-TRIAZOL-4-YL)THIOUREA
【CAS】
【MDL】
MFCD05154908
【English Synonyms】
【Formula】
C12 H15 N5 S2
【MolWeight】
293.418
【Inchi】
InChI=1S/C12H15N5S2/c1-7-4-5-8(2)10(6-7)13-11(18)16-17-9(3)14-15-12(17)19/h4-6H,1-3H3,(H,15,19)(H2,13,16,18)
【InChIKey】
InChIKey=RFCBBUBRSPSGNE-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1)NC(=S)Nn2c(n[nH]c2=S)C)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2,5-DIMETHYLPHENYL)-N'-(3-METHYL-5-THIOXO-1,5-DIHYDRO-4H-1,2,4-TRIAZOL-4-YL)THIOUREA.cml
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Catalog No:L444839-1EA 10MG
Country/Region:United States
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