Vitas-M small molecule compound
3-[(4-tert-butylbenzyl)sulfanyl]-4-methyl-5-(3-methylphenyl)-4H-1,2,4-triazole
Catalog ID
STK585218
SMILES Cc1cccc(c1)c1nnc(n1C)SCc1ccc(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/c1-15-7-6-8-17(13-15)19-22-23-20(24(19)5)25-14-16-9-11-18(12-10-16)21(2,3)4/h6-13H,14H2,1-5H3InChIKey
XYRUNCXABVNZLS-UHFFFAOYSA-NSynonyms
743445-21-83((4(tertbutyl)benzyl)thio)4methyl5(mtolyl)4H124triazole
3((4tertbutylbenzyl)sulfanyl)4methyl5(3methylphenyl)4H124triazole
3((4TERTBUTYLPHENYL)METHYLSULFANYL)4METHYL5(3METHYLPHENYL)124TRIAZOLE
743445218
CC1=CC=CC(=C1)C2=NN=C(N2C)SCC3=CC=C(C=C3)C(C)(C)C
InChI=1SC21H25N3Sc11576817(1315)19222320(24(19)5)25141691118(121016)21(23)4h613H14H215H3
MFCD05263286
ZINC000002324007
ZINC02324007
ZINC2324007
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