Vitas-M small molecule compound
1-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3,3-dimethylbutan-2-one
Catalog ID
STL069879
SMILES Clc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)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 C20H20ClN3OS MW 385.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN3OS/c1-20(2,3)17(25)13-26-19-23-22-18(14-9-11-15(21)12-10-14)24(19)16-7-5-4-6-8-16/h4-12H,13H2,1-3H3InChIKey
PZTDTCOHGYGCOJ-UHFFFAOYSA-NSynonyms
557097-92-41((5(4CHLOROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)33DIMETHYLBUTAN2ONE
1((5(4CHLOROPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)33DIMETHYL2BUTANONE
1((5(4chlorophenyl)4phenyl4H124triazol3yl)sulfanyl)33dimethylbutan2one
1((5(4chlorophenyl)4phenyl4H124triazol3yl)thio)33dimethylbutan2one
557097924
CC(C)(C)C(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)Cl
InChI=1SC20H20ClN3OSc120(23)17(25)132619232218(1491115(21)121014)24(19)167546816h412H13H213H3
MFCD02102871
ZINC000000643202
ZINC00643202
ZINC643202
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