Vitas-M small molecule compound
4-(4-methylbenzyl)-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK444069
SMILES Cc1ccc(cc1)Cn1c(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 C18H19N3S MW 309.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3S/c1-14-7-9-16(10-8-14)13-21-17(19-20-18(21)22)12-11-15-5-3-2-4-6-15/h2-10H,11-13H2,1H3,(H,20,22)InChIKey
BAVLRHKNVIQISV-UHFFFAOYSA-NSynonyms
4((4methylphenyl)methyl)3(2phenylethyl)1H124triazole5thione
4((4METHYLPHENYL)METHYL)5(2PHENYLETHYL)124TRIAZOLE3THIOL
4(4methylbenzyl)5(2phenylethyl)4H124triazole3thiol
CC1=CC=C(C=C1)CN2C(=NNC2=S)CCC3=CC=CC=C3
InChI=1SC18H19N3Sc1147916(10814)132117(192018(21)22)1211155324615h210H1113H21H3(H2022)
MFCD04055263
ZINC000006788334
ZINC06788334
ZINC6788334
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