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

Systemtic Name: N-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl]-3-phenyl-propanamide Openeye Name: N-[(4-chloro-2,5-dimethoxy-phenyl)carbamothioyl]-3-phenyl-propanamide CAS Name: N-[(4-chloro-2,5-dimethoxyanilino)-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3-phenylpropanamide Traditional Name: N-[(4-chloro-2,5-dimethoxy-phenyl)thiocarbamoyl]-3-phenyl-propionamide Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC(=O)CCC2=CC=CC=C2)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC(=O)CCC2=CC=CC=C2)OC)Cl

InChI

InChI=1S/C18H19ClN2O3S/c1-23-15-11-14(16(24-2)10-13(15)19)20-18(25)21-17(22)9-8-12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H2,20,21,22,25)