N-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl]-4-phenoxy-butanamide

Systemtic Name: N-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl]-4-phenoxy-butanamide Openeye Name: N-[(4-chloro-2,5-dimethoxy-phenyl)carbamothioyl]-4-phenoxy-butanamide CAS Name: N-[(4-chloro-2,5-dimethoxyanilino)-sulfanylidenemethyl]-4-phenoxybutanamide IUPAC Name: N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-4-phenoxybutanamide Traditional Name: N-[(4-chloro-2,5-dimethoxy-phenyl)thiocarbamoyl]-4-phenoxy-butyramide Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC(=O)CCCOC2=CC=CC=C2)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC(=O)CCCOC2=CC=CC=C2)OC)Cl

InChI

InChI=1S/C19H21ClN2O4S/c1-24-16-12-15(17(25-2)11-14(16)20)21-19(27)22-18(23)9-6-10-26-13-7-4-3-5-8-13/h3-5,7-8,11-12H,6,9-10H2,1-2H3,(H2,21,22,23,27)