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

Systemtic Name: N-[3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-2-methyl-5-phenyl-pyrrol-1-yl]pyridine-4-carboxamide Openeye Name: N-[3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-2-methyl-5-phenyl-pyrrol-1-yl]pyridine-4-carboxamide CAS Name: N-[3-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]-2-methyl-5-phenyl-1-pyrrolyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-2-methyl-5-phenylpyrrol-1-yl]pyridine-4-carboxamide Traditional Name: N-[3-[[4-(2-methoxyphenyl)piperazino]methyl]-2-methyl-5-phenyl-pyrrol-1-yl]isonicotinamide Formula: C29H31N5O2 MolecularWeight: 481.58874

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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)C5=CC=CC=C5OC

Isomeric SMILES

CC1=C(C=C(N1NC(=O)C2=CC=NC=C2)C3=CC=CC=C3)CN4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C29H31N5O2/c1-22-25(21-32-16-18-33(19-17-32)26-10-6-7-11-28(26)36-2)20-27(23-8-4-3-5-9-23)34(22)31-29(35)24-12-14-30-15-13-24/h3-15,20H,16-19,21H2,1-2H3,(H,31,35)