Vitas-M small molecule compound
1-(4-chlorophenyl)-2-{[4-methyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK154217
SMILES Clc1ccc(cc1)C(=O)CSc1nnc(n1C)c1ccc(cc1)[N+](=O)[O-]
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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 C17H13ClN4O3S MW 388.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4O3S/c1-21-16(12-4-8-14(9-5-12)22(24)25)19-20-17(21)26-10-15(23)11-2-6-13(18)7-3-11/h2-9H,10H2,1H3InChIKey
OPOGMBQHRRTCIE-UHFFFAOYSA-NSynonyms
1(4CHLOROPHENYL)2((4METHYL5(4NITROPHENYL)124TRIAZOL3YL)SULFANYL)ETHANONE
1(4CHLOROPHENYL)2((4METHYL5(4NITROPHENYL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
Clc1ccc(cc1)C(=O)CSc1nnc(n1C)c1ccc(cc1)(N+)(=O)(O)
CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC17H13ClN4O3Sc12116(124814(9512)22(24)25)192017(21)261015(23)112613(18)7311h29H10H21H3
MFCD03876982
ZINC000002836481
ZINC02836481
ZINC2836481
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