Vitas-M small molecule compound
4-[({[4-(ethoxycarbonyl)phenyl]carbamothioyl}amino)methyl]benzoic acid
Catalog ID
STK456317
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NCc1ccc(cc1)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/c1-2-24-17(23)14-7-9-15(10-8-14)20-18(25)19-11-12-3-5-13(6-4-12)16(21)22/h3-10H,2,11H2,1H3,(H,21,22)(H2,19,20,25)InChIKey
OHWDMTQFWMBFJV-UHFFFAOYSA-NSynonyms
4(((((4(ETHOXYCARBONYL)PHENYL)AMINO)THIOXOMETHYL)AMINO)METHYL)BENZOICACID
4((((4(ethoxycarbonyl)phenyl)carbamothioyl)amino)methyl)benzoicacid
4(((4ETHOXYCARBONYLPHENYL)CARBAMOTHIOYLAMINO)METHYL)BENZOICACID
CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)C(=O)O
InChI=1SC18H18N2O4Sc122417(23)147915(10814)2018(25)1911123513(6412)16(21)22h310H211H21H3(H2122)(H2192025)
MFCD04285310
ZINC000002858425
ZINC2858425
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