Vitas-M small molecule compound
3-(4-tert-butylphenyl)-4-methyl-5-[(2-methylbenzyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STL347804
SMILES Cc1ccccc1CSc1nnc(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/c1-15-8-6-7-9-17(15)14-25-20-23-22-19(24(20)5)16-10-12-18(13-11-16)21(2,3)4/h6-13H,14H2,1-5H3InChIKey
MGPOURXUKJJFNT-UHFFFAOYSA-NSynonyms
861148-05-23(4(tertbutyl)phenyl)4methyl5((2methylbenzyl)thio)4H124triazole
3(4tertbutylphenyl)4methyl5((2methylbenzyl)sulfanyl)4H124triazole
3(4TERTBUTYLPHENYL)4METHYL5((2METHYLPHENYL)METHYLSULFANYL)124TRIAZOLE
861148052
CC1=CC=CC=C1CSC2=NN=C(N2C)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC21H25N3Sc115867917(15)142520232219(24(20)5)16101218(131116)21(23)4h613H14H215H3
MFCD05684353
ZINC000005478305
ZINC05478305
ZINC5478305
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