Vitas-M small molecule compound
2-chloro-N-[1-(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Catalog ID
STK133053
SMILES CC(c1nnc(n1C)S)NC(=O)c1ccccc1Cl
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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 C12H13ClN4OS MW 296.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13ClN4OS/c1-7(10-15-16-12(19)17(10)2)14-11(18)8-5-3-4-6-9(8)13/h3-7H,1-2H3,(H,14,18)(H,16,19)InChIKey
XVKSGUJYQPHBFX-UHFFFAOYSA-NSynonyms
2CHLORON(1(4METHYL5SULFANYL4H124TRIAZOL3YL)ETHYL)BENZAMIDE
2CHLORON(1(4METHYL5SULFANYLIDENE1H124TRIAZOL3YL)ETHYL)BENZAMIDE
2CHLORON(1(5MERCAPTO4METHYL4H(124)TRIAZOL3YL)ETHYL)BENZAMIDE
CC(C1=NNC(=S)N1C)NC(=O)C2=CC=CC=C2Cl
InChI=1SC12H13ClN4OSc17(10151612(19)17(10)2)1411(18)853469(8)13h37H12H3(H1418)(H1619)
MFCD05238256
ZINC000005486912
ZINC000005487490
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