3,5-bis(chloranyl)-N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3,5-bis(chloranyl)-N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3,5-dichloro-N-[[3-chloro-4-(1-piperidyl)phenyl]carbamothioyl]-4-methoxy-benzamide CAS Name: 3,5-dichloro-N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3,5-dichloro-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3,5-dichloro-N-[(3-chloro-4-piperidino-phenyl)thiocarbamoyl]-4-methoxy-benzamide Formula: C20H20Cl3N3O2S MolecularWeight: 472.8157

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl)Cl

InChI

InChI=1S/C20H20Cl3N3O2S/c1-28-18-15(22)9-12(10-16(18)23)19(27)25-20(29)24-13-5-6-17(14(21)11-13)26-7-3-2-4-8-26/h5-6,9-11H,2-4,7-8H2,1H3,(H2,24,25,27,29)