N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-2-phenoxy-ethanamide

Systemtic Name: N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[[3-chloro-4-(1-piperidyl)phenyl]carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[(3-chloro-4-piperidino-phenyl)thiocarbamoyl]-2-phenoxy-acetamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)COC3=CC=CC=C3)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)COC3=CC=CC=C3)Cl

InChI

InChI=1S/C20H22ClN3O2S/c21-17-13-15(9-10-18(17)24-11-5-2-6-12-24)22-20(27)23-19(25)14-26-16-7-3-1-4-8-16/h1,3-4,7-10,13H,2,5-6,11-12,14H2,(H2,22,23,25,27)