Vitas-M small molecule compound
4-(3-chloro-4-methylphenyl)-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK444119
SMILES Cc1ccc(cc1Cl)n1c(nnc1S)CCc1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H16ClN3S MW 329.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3S/c1-12-7-9-14(11-15(12)18)21-16(19-20-17(21)22)10-8-13-5-3-2-4-6-13/h2-7,9,11H,8,10H2,1H3,(H,20,22)InChIKey
PXUZUKHREQZZMJ-UHFFFAOYSA-NSynonyms
4(3chloro4methylphenyl)3(2phenylethyl)1H124triazole5thione
4(3CHLORO4METHYLPHENYL)5(2PHENYLETHYL)124TRIAZOLE3THIOL
4(3chloro4methylphenyl)5(2phenylethyl)4H124triazole3thiol
CC1=C(C=C(C=C1)N2C(=NNC2=S)CCC3=CC=CC=C3)Cl
InChI=1SC17H16ClN3Sc1127914(1115(12)18)2116(192017(21)22)108135324613h27911H810H21H3(H2022)
MFCD04055318
ZINC000006401126
ZINC06401126
ZINC6401126
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