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

Systemtic Name: 1-(4-chlorophenyl)-N-[3-cyano-2-(4-morpholin-4-ylpiperidin-1-yl)phenyl]pyrrole-3-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-[3-cyano-2-(4-morpholino-1-piperidyl)phenyl]pyrrole-3-carboxamide CAS Name: 1-(4-chlorophenyl)-N-[3-cyano-2-[4-(4-morpholinyl)-1-piperidinyl]phenyl]-3-pyrrolecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-[3-cyano-2-(4-morpholin-4-ylpiperidin-1-yl)phenyl]pyrrole-3-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-[3-cyano-2-(4-morpholinopiperidino)phenyl]pyrrole-3-carboxamide Formula: C27H28ClN5O2 MolecularWeight: 489.99652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCOCC2)C3=C(C=CC=C3NC(=O)C4=CN(C=C4)C5=CC=C(C=C5)Cl)C#N

Isomeric SMILES

C1CN(CCC1N2CCOCC2)C3=C(C=CC=C3NC(=O)C4=CN(C=C4)C5=CC=C(C=C5)Cl)C#N

InChI

InChI=1S/C27H28ClN5O2/c28-22-4-6-23(7-5-22)33-11-8-21(19-33)27(34)30-25-3-1-2-20(18-29)26(25)32-12-9-24(10-13-32)31-14-16-35-17-15-31/h1-8,11,19,24H,9-10,12-17H2,(H,30,34)