1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-2,5-dimethyl-pyrrole-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-2,5-dimethyl-pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(4-morpholino-1-piperidyl)phenyl]-2,5-dimethyl-pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-[4-(4-morpholinyl)-1-piperidinyl]phenyl]-2,5-dimethyl-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-2,5-dimethylpyrrole-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(4-morpholinopiperidino)phenyl]-2,5-dimethyl-pyrrole-3-carboxamide Formula: C30H33N5O4 MolecularWeight: 527.61412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)NC4=CC(=C(C=C4)N5CCC(CC5)N6CCOCC6)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)NC4=CC(=C(C=C4)N5CCC(CC5)N6CCOCC6)C#N

InChI

InChI=1S/C30H33N5O4/c1-20-15-26(21(2)35(20)25-4-6-28-29(17-25)39-19-38-28)30(36)32-23-3-5-27(22(16-23)18-31)34-9-7-24(8-10-34)33-11-13-37-14-12-33/h3-6,15-17,24H,7-14,19H2,1-2H3,(H,32,36)