N-[[4-[(3-chlorophenyl)carbonylamino]phenyl]carbamothioyl]-3-(phenoxymethyl)benzamide

Systemtic Name: N-[[4-[(3-chlorophenyl)carbonylamino]phenyl]carbamothioyl]-3-(phenoxymethyl)benzamide Openeye Name: N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]-3-(phenoxymethyl)benzamide CAS Name: N-[[4-[[(3-chlorophenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-3-(phenoxymethyl)benzamide IUPAC Name: N-[[4-[(3-chlorobenzoyl)amino]phenyl]carbamothioyl]-3-(phenoxymethyl)benzamide Traditional Name: N-[[4-[(3-chlorobenzoyl)amino]phenyl]thiocarbamoyl]-3-(phenoxymethyl)benzamide Formula: C28H22ClN3O3S MolecularWeight: 516.01058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C28H22ClN3O3S/c29-22-9-5-8-21(17-22)26(33)30-23-12-14-24(15-13-23)31-28(36)32-27(34)20-7-4-6-19(16-20)18-35-25-10-2-1-3-11-25/h1-17H,18H2,(H,30,33)(H2,31,32,34,36)