N-[2-methyl-3-[(4-methylpiperazin-1-yl)methyl]-5-phenyl-pyrrol-1-yl]pyridine-4-carboxamide

Systemtic Name: N-[2-methyl-3-[(4-methylpiperazin-1-yl)methyl]-5-phenyl-pyrrol-1-yl]pyridine-4-carboxamide Openeye Name: N-[2-methyl-3-[(4-methylpiperazin-1-yl)methyl]-5-phenyl-pyrrol-1-yl]pyridine-4-carboxamide CAS Name: N-[2-methyl-3-[(4-methyl-1-piperazinyl)methyl]-5-phenyl-1-pyrrolyl]-4-pyridinecarboxamide IUPAC Name: N-[2-methyl-3-[(4-methylpiperazin-1-yl)methyl]-5-phenylpyrrol-1-yl]pyridine-4-carboxamide Traditional Name: N-[2-methyl-3-[(4-methylpiperazino)methyl]-5-phenyl-pyrrol-1-yl]isonicotinamide Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1NC(=O)C2=CC=NC=C2)C3=CC=CC=C3)CN4CCN(CC4)C

Isomeric SMILES

CC1=C(C=C(N1NC(=O)C2=CC=NC=C2)C3=CC=CC=C3)CN4CCN(CC4)C

InChI

InChI=1S/C23H27N5O/c1-18-21(17-27-14-12-26(2)13-15-27)16-22(19-6-4-3-5-7-19)28(18)25-23(29)20-8-10-24-11-9-20/h3-11,16H,12-15,17H2,1-2H3,(H,25,29)