N-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(4-chloro-2,5-dimethoxy-phenyl)carbamothioyl]benzamide CAS Name: N-[(4-chloro-2,5-dimethoxyanilino)-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(4-chloro-2,5-dimethoxy-phenyl)thiocarbamoyl]benzamide Formula: C23H21ClN2O4S MolecularWeight: 456.94184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3)OC)Cl

InChI

InChI=1S/C23H21ClN2O4S/c1-28-20-13-19(21(29-2)12-18(20)24)25-23(31)26-22(27)16-9-6-10-17(11-16)30-14-15-7-4-3-5-8-15/h3-13H,14H2,1-2H3,(H2,25,26,27,31)