Vitas-M small molecule compound
methyl 4-({[(3,4,5-triethoxyphenyl)carbonyl]carbamothioyl}amino)benzoate
Catalog ID
STK098267
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)Nc1ccc(cc1)C(=O)OC
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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 C22H26N2O6S MW 446.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O6S/c1-5-28-17-12-15(13-18(29-6-2)19(17)30-7-3)20(25)24-22(31)23-16-10-8-14(9-11-16)21(26)27-4/h8-13H,5-7H2,1-4H3,(H2,23,24,25,31)InChIKey
WTBSSHOJTDQDMH-UHFFFAOYSA-NSynonyms
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC
CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)Nc1ccc(cc1)C(=O)OC
InChI=1SC22H26N2O6Sc1528171215(1318(2962)19(17)3073)20(25)2422(31)231610814(91116)21(26)274h813H57H214H3(H223242531)
METHYL4((((345TRIETHOXYBENZOYL)AMINO)CARBOTHIOYL)AMINO)BENZOATE
METHYL4((((345TRIETHOXYPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOATE
METHYL4((345TRIETHOXYBENZOYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD02630344
STK098267
ZINC000008385978
ZINC08385978
ZINC8385978
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