Vitas-M small molecule compound
4-{4-methyl-5-[(4-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}aniline
Catalog ID
STK115946
SMILES Cc1ccc(cc1)CSc1nnc(n1C)c1ccc(cc1)N
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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 C17H18N4S MW 310.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4S/c1-12-3-5-13(6-4-12)11-22-17-20-19-16(21(17)2)14-7-9-15(18)10-8-14/h3-10H,11,18H2,1-2H3InChIKey
NAZYVTAVJMBPLA-UHFFFAOYSA-NSynonyms
4(4METHYL5((4METHYLBENZYL)SULFANYL)4H124TRIAZOL3YL)ANILINE
4(4METHYL5((4METHYLBENZYL)SULFANYL)4H124TRIAZOL3YL)PHENYLAMINE
4(4METHYL5((4METHYLPHENYL)METHYLSULFANYL)124TRIAZOL3YL)ANILINE
CC1=CC=C(C=C1)CSC2=NN=C(N2C)C3=CC=C(C=C3)N
InChI=1SC17H18N4Sc1123513(6412)112217201916(21(17)2)147915(18)10814h310H1118H212H3
MFCD02627933
ZINC000000368125
ZINC00368125
ZINC368125
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