3,5-bis(chloranyl)-4-methoxy-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 3,5-bis(chloranyl)-4-methoxy-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 3,5-dichloro-4-methoxy-N-[[2-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dichloro-4-methoxy-N-[[2-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dichloro-4-methoxy-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 3,5-dichloro-4-methoxy-N-[(2-piperidinophenyl)thiocarbamoyl]benzamide Formula: C20H21Cl2N3O2S MolecularWeight: 438.37064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=O)NC(=S)NC2=CC=CC=C2N3CCCCC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=O)NC(=S)NC2=CC=CC=C2N3CCCCC3)Cl

InChI

InChI=1S/C20H21Cl2N3O2S/c1-27-18-14(21)11-13(12-15(18)22)19(26)24-20(28)23-16-7-3-4-8-17(16)25-9-5-2-6-10-25/h3-4,7-8,11-12H,2,5-6,9-10H2,1H3,(H2,23,24,26,28)