3-chloranyl-4-methoxy-N-[[4-(4-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-chloranyl-4-methoxy-N-[[4-(4-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide Openeye Name: 3-chloro-4-methoxy-N-[[4-(4-methyl-1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 3-chloro-4-methoxy-N-[[4-(4-methyl-1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-4-methoxy-N-[[4-(4-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide Traditional Name: 3-chloro-4-methoxy-N-[[4-(4-methylpiperidino)phenyl]thiocarbamoyl]benzamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H24ClN3O2S/c1-14-9-11-25(12-10-14)17-6-4-16(5-7-17)23-21(28)24-20(26)15-3-8-19(27-2)18(22)13-15/h3-8,13-14H,9-12H2,1-2H3,(H2,23,24,26,28)