3-chloranyl-4-methoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-chloranyl-4-methoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 3-chloro-4-methoxy-N-[[4-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 3-chloro-4-methoxy-N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-4-methoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 3-chloro-4-methoxy-N-[(4-piperidinophenyl)thiocarbamoyl]benzamide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3)Cl

InChI

InChI=1S/C20H22ClN3O2S/c1-26-18-10-5-14(13-17(18)21)19(25)23-20(27)22-15-6-8-16(9-7-15)24-11-3-2-4-12-24/h5-10,13H,2-4,11-12H2,1H3,(H2,22,23,25,27)