Vitas-M small molecule compound
5-[(benzylsulfanyl)methyl]-4-(4-ethylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK440394
SMILES CCc1ccc(cc1)n1c(CSCc2ccccc2)nnc1S
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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 C18H19N3S2 MW 341.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3S2/c1-2-14-8-10-16(11-9-14)21-17(19-20-18(21)22)13-23-12-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,20,22)InChIKey
BIKICJVAYXOLKK-UHFFFAOYSA-NSynonyms
3(BENZYLSULFANYLMETHYL)4(4ETHYLPHENYL)1H124TRIAZOLE5THIONE
4(4ETHYLPHENYL)5((PHENYLMETHYLTHIO)METHYL)124TRIAZOLE3THIOL
5((benzylsulfanyl)methyl)4(4ethylphenyl)4H124triazole3thiol
CCC1=CC=C(C=C1)N2C(=NNC2=S)CSCC3=CC=CC=C3
InChI=1SC18H19N3S2c121481016(11914)2117(192018(21)22)132312156435715h311H21213H21H3(H2022)
MFCD03946246
ZINC000006388134
ZINC6388134
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