4-methoxy-3-[(4-phenylphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: 4-methoxy-3-[(4-phenylphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: 4-methoxy-3-[(4-phenylbenzoyl)carbamothioylamino]benzoate CAS Name: 4-methoxy-3-[[[[oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoate IUPAC Name: 4-methoxy-3-[(4-phenylbenzoyl)carbamothioylamino]benzoate Traditional Name: 4-methoxy-3-[(4-phenylbenzoyl)thiocarbamoylamino]benzoate Formula: C22H17N2O4S- MolecularWeight: 405.44638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H18N2O4S/c1-28-19-12-11-17(21(26)27)13-18(19)23-22(29)24-20(25)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-13H,1H3,(H,26,27)(H2,23,24,25,29)/p-1