Vitas-M small molecule compound
3-(4-tert-butylphenyl)-4-methyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STL348146
SMILES Cc1cccc(c1)CSc1nnc(n1C)c1ccc(cc1)C(C)(C)C
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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 C21H25N3S MW 351.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3S/c1-15-7-6-8-16(13-15)14-25-20-23-22-19(24(20)5)17-9-11-18(12-10-17)21(2,3)4/h6-13H,14H2,1-5H3InChIKey
SYNWHMQXNFPFGS-UHFFFAOYSA-NSynonyms
861645-54-73(4(tertbutyl)phenyl)4methyl5((3methylbenzyl)thio)4H124triazole
3(4tertbutylphenyl)4methyl5((3methylbenzyl)sulfanyl)4H124triazole
3(4TERTBUTYLPHENYL)4METHYL5((3METHYLPHENYL)METHYLSULFANYL)124TRIAZOLE
861645547
CC1=CC(=CC=C1)CSC2=NN=C(N2C)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC21H25N3Sc11576816(1315)142520232219(24(20)5)1791118(121017)21(23)4h613H14H215H3
MFCD05686216
ZINC000005499446
ZINC05499446
ZINC5499446
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