Vitas-M small molecule compound
4-{[(E)-(3-chlorophenyl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK596819
SMILES COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1cccc(c1)Cl
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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 C18H17ClN4O3S MW 404.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O3S/c1-24-14-8-12(9-15(25-2)16(14)26-3)17-21-22-18(27)23(17)20-10-11-5-4-6-13(19)7-11/h4-10H,1-3H3,(H,22,27)/b20-10+InChIKey
ZRJWEFUVYFPVEP-KEBDBYFISA-NSynonyms
488708-57-24(((E)(3chlorophenyl)methylidene)amino)5(345trimethoxyphenyl)24dihydro3H124triazole3thione
4((1E)2(3CHLOROPHENYL)1AZAVINYL)5(345TRIMETHOXYPHENYL)124TRIAZOLE3THIOL
4((E)(3CHLOROPHENYL)METHYLIDENEAMINO)3(345TRIMETHOXYPHENYL)1H124TRIAZOLE5THIONE
488708572
COC1=CC(=CC(=C1OC)OC)C2=NNC(=S)N2N=CC3=CC(=CC=C3)Cl
COc1cc(cc(c1OC)OC)c1n(nH)c(=S)n1N=Cc1cccc(c1)Cl
InChI=1SC18H17ClN4O3Sc12414812(915(252)16(14)263)17212218(27)23(17)20101154613(19)711h410H13H3(H2227)b2010+
MFCD07201280
ZINC000006004619
ZINC33341748
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