Vitas-M small molecule compound
3-({[(3-ethoxyphenyl)carbonyl]carbamothioyl}amino)-2-methylbenzoic acid
Catalog ID
STK102449
SMILES CCOc1cccc(c1)C(=O)NC(=S)Nc1cccc(c1C)C(=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 C18H18N2O4S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S/c1-3-24-13-7-4-6-12(10-13)16(21)20-18(25)19-15-9-5-8-14(11(15)2)17(22)23/h4-10H,3H2,1-2H3,(H,22,23)(H2,19,20,21,25)InChIKey
ZOPWQJIKCCKEON-UHFFFAOYSA-NSynonyms
532434-13-23((((3ETHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)2METHYLBENZOICACID
3((3ETHOXYBENZOYL)CARBAMOTHIOYLAMINO)2METHYLBENZOICACID
532434132
BENZOICACID3((((3ETHOXYBENZOYL)AMINO)THIOXOMETHYL)AMINO)2METHYL
CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2C)C(=O)O
InChI=1SC18H18N2O4Sc13241374612(1013)16(21)2018(25)191595814(11(15)2)17(22)23h410H3H212H3(H2223)(H219202125)
MFCD03570427
ZINC000000679096
ZINC679096
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