4-butoxy-N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[[3-chloro-4-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(3-chloro-4-piperidino-phenyl)thiocarbamoyl]benzamide Formula: C23H28ClN3O2S MolecularWeight: 446.00532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl

InChI

InChI=1S/C23H28ClN3O2S/c1-2-3-15-29-19-10-7-17(8-11-19)22(28)26-23(30)25-18-9-12-21(20(24)16-18)27-13-5-4-6-14-27/h7-12,16H,2-6,13-15H2,1H3,(H2,25,26,28,30)