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

Systemtic Name: N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-1-(3,4-dimethoxyphenyl)pyrrole-3-carboxamide Openeye Name: N-[3-cyano-4-(4-morpholino-1-piperidyl)phenyl]-1-(3,4-dimethoxyphenyl)pyrrole-3-carboxamide CAS Name: N-[3-cyano-4-[4-(4-morpholinyl)-1-piperidinyl]phenyl]-1-(3,4-dimethoxyphenyl)-3-pyrrolecarboxamide IUPAC Name: N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-1-(3,4-dimethoxyphenyl)pyrrole-3-carboxamide Traditional Name: N-[3-cyano-4-(4-morpholinopiperidino)phenyl]-1-(3,4-dimethoxyphenyl)pyrrole-3-carboxamide Formula: C29H33N5O4 MolecularWeight: 515.60342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=CC(=C2)C(=O)NC3=CC(=C(C=C3)N4CCC(CC4)N5CCOCC5)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=CC(=C2)C(=O)NC3=CC(=C(C=C3)N4CCC(CC4)N5CCOCC5)C#N)OC

InChI

InChI=1S/C29H33N5O4/c1-36-27-6-4-25(18-28(27)37-2)34-10-7-21(20-34)29(35)31-23-3-5-26(22(17-23)19-30)33-11-8-24(9-12-33)32-13-15-38-16-14-32/h3-7,10,17-18,20,24H,8-9,11-16H2,1-2H3,(H,31,35)