Vitas-M small molecule compound
3-cyclopropyl-5-[(4-methylbenzyl)sulfanyl]-4-(propan-2-yl)-4H-1,2,4-triazole
Catalog ID
STK481892
SMILES Cc1ccc(cc1)CSc1nnc(n1C(C)C)C1CC1
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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 C16H21N3S MW 287.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3S/c1-11(2)19-15(14-8-9-14)17-18-16(19)20-10-13-6-4-12(3)5-7-13/h4-7,11,14H,8-10H2,1-3H3InChIKey
WARWGWCQNKHFPD-UHFFFAOYSA-NSynonyms
3cyclopropyl5((4methylbenzyl)sulfanyl)4(propan2yl)4H124triazole
3CYCLOPROPYL5((4METHYLPHENYL)METHYLSULFANYL)4PROPAN2YL124TRIAZOLE
5CYCLOPROPYL4(METHYLETHYL)3((4METHYLPHENYL)METHYLTHIO)124TRIAZOLE
CC1=CC=C(C=C1)CSC2=NN=C(N2C(C)C)C3CC3
InChI=1SC16H21N3Sc111(2)1915(148914)171816(19)2010136412(3)5713h471114H810H213H3
MFCD06034348
ZINC000006731152
ZINC06731152
ZINC6731152
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