N-[[4-[(3-chlorophenyl)carbonylamino]phenyl]carbamothioyl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[[4-[(3-chlorophenyl)carbonylamino]phenyl]carbamothioyl]-3,4,5-triethoxy-benzamide Openeye Name: N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]-3,4,5-triethoxy-benzamide CAS Name: N-[[4-[[(3-chlorophenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-3,4,5-triethoxybenzamide IUPAC Name: N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]-3,4,5-triethoxybenzamide Traditional Name: N-[[4-[(3-chlorobenzoyl)amino]phenyl]thiocarbamoyl]-3,4,5-triethoxy-benzamide Formula: C27H28ClN3O5S MolecularWeight: 542.04632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C27H28ClN3O5S/c1-4-34-22-15-18(16-23(35-5-2)24(22)36-6-3)26(33)31-27(37)30-21-12-10-20(11-13-21)29-25(32)17-8-7-9-19(28)14-17/h7-16H,4-6H2,1-3H3,(H,29,32)(H2,30,31,33,37)