2,4-bis(chloranyl)-N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[[4-(2-methyl-1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[4-(2-methyl-1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[[4-(2-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[[4-(2-methylpiperidino)phenyl]thiocarbamoyl]benzamide Formula: C20H21Cl2N3OS MolecularWeight: 422.37124

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1CCCCN1C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H21Cl2N3OS/c1-13-4-2-3-11-25(13)16-8-6-15(7-9-16)23-20(27)24-19(26)17-10-5-14(21)12-18(17)22/h5-10,12-13H,2-4,11H2,1H3,(H2,23,24,26,27)