Vitas-M small molecule compound
2-chloro-5-({[(2-methylphenyl)carbonyl]carbamothioyl}amino)benzoic acid
Catalog ID
STK020340
SMILES S=C(NC(=O)c1ccccc1C)Nc1ccc(c(c1)C(=O)O)Cl
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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 C16H13ClN2O3S MW 348.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN2O3S/c1-9-4-2-3-5-11(9)14(20)19-16(23)18-10-6-7-13(17)12(8-10)15(21)22/h2-8H,1H3,(H,21,22)(H2,18,19,20,23)InChIKey
VRIWIJJLHKWAIC-UHFFFAOYSA-NSynonyms
434308-87-92CHLORO5((((2METHYLPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
2CHLORO5((2METHYLBENZOYL)CARBAMOTHIOYLAMINO)BENZOICACID
434308879
BENZOICACID2CHLORO5((((2METHYLBENZOYL)AMINO)THIOXOMETHYL)AMINO)
CC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)O
InChI=1SC16H13ClN2O3Sc19423511(9)14(20)1916(23)18106713(17)12(810)15(21)22h28H1H3(H2122)(H218192023)
MFCD03453785
S=C(NC(=O)c1ccccc1C)Nc1ccc(c(c1)C(=O)O)Cl
STK020340
ZINC000006861005
ZINC6861005
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