3-chloranyl-N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[3-cyano-4-(4-morpholino-1-piperidyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-cyano-4-[4-(4-morpholinyl)-1-piperidinyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[3-cyano-4-(4-morpholinopiperidino)phenyl]benzothiophene-2-carboxamide Formula: C25H25ClN4O2S MolecularWeight: 481.0096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCOCC2)C3=C(C=C(C=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl)C#N

Isomeric SMILES

C1CN(CCC1N2CCOCC2)C3=C(C=C(C=C3)NC(=O)C4=C(C5=CC=CC=C5S4)Cl)C#N

InChI

InChI=1S/C25H25ClN4O2S/c26-23-20-3-1-2-4-22(20)33-24(23)25(31)28-18-5-6-21(17(15-18)16-27)30-9-7-19(8-10-30)29-11-13-32-14-12-29/h1-6,15,19H,7-14H2,(H,28,31)