N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]-2-methoxy-3-methyl-benzamide

Systemtic Name: N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]-2-methoxy-3-methyl-benzamide Openeye Name: N-[[3-chloro-2-(1-piperidyl)phenyl]carbamothioyl]-2-methoxy-3-methyl-benzamide CAS Name: N-[[3-chloro-2-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2-methoxy-3-methylbenzamide IUPAC Name: N-[(3-chloro-2-piperidin-1-ylphenyl)carbamothioyl]-2-methoxy-3-methylbenzamide Traditional Name: N-[(3-chloro-2-piperidino-phenyl)thiocarbamoyl]-2-methoxy-3-methyl-benzamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)N3CCCCC3

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=C(C(=CC=C2)Cl)N3CCCCC3

InChI

InChI=1S/C21H24ClN3O2S/c1-14-8-6-9-15(19(14)27-2)20(26)24-21(28)23-17-11-7-10-16(22)18(17)25-12-4-3-5-13-25/h6-11H,3-5,12-13H2,1-2H3,(H2,23,24,26,28)