Vitas-M small molecule compound
4-[(2-chlorobenzylidene)amino]-5-(4-methylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK506959
SMILES Cc1ccc(cc1)c1nnc(n1/N=C\c1ccccc1Cl)S
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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 C16H13ClN4S MW 328.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN4S/c1-11-6-8-12(9-7-11)15-19-20-16(22)21(15)18-10-13-4-2-3-5-14(13)17/h2-10H,1H3,(H,20,22)InChIKey
ARSNTVPNZSVQCJ-UHFFFAOYSA-NSynonyms
(E)4((2chlorobenzylidene)amino)5(ptolyl)4H124triazole3thiol
4((2chlorobenzylidene)amino)5(4methylphenyl)4H124triazole3thiol
4((2CHLOROPHENYL)METHYLIDENEAMINO)3(4METHYLPHENYL)1H124TRIAZOLE5THIONE
CC1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC=CC=C3Cl
Cc1ccc(cc1)c1nnc(n1N=Cc1ccccc1Cl)S
InChI=1SC16H13ClN4Sc1116812(9711)15192016(22)21(15)181013423514(13)17h210H1H3(H2022)
MFCD03305961
ZINC000252429303
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