N-(3-azanylpropyl)-N-[[3-[3-(2-phenylethanoylamino)-4-pyrrolidin-1-yl-phenyl]phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: N-(3-azanylpropyl)-N-[[3-[3-(2-phenylethanoylamino)-4-pyrrolidin-1-yl-phenyl]phenyl]methyl]pyridine-3-carboxamide Openeye Name: N-(3-aminopropyl)-N-[[3-[3-[(2-phenylacetyl)amino]-4-pyrrolidin-1-yl-phenyl]phenyl]methyl]pyridine-3-carboxamide CAS Name: N-(3-aminopropyl)-N-[[3-[3-[(1-oxo-2-phenylethyl)amino]-4-(1-pyrrolidinyl)phenyl]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-(3-aminopropyl)-N-[[3-[3-[(2-phenylacetyl)amino]-4-pyrrolidin-1-ylphenyl]phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-(3-aminopropyl)-N-[3-[3-[(2-phenylacetyl)amino]-4-pyrrolidino-phenyl]benzyl]nicotinamide Formula: C34H37N5O2 MolecularWeight: 547.68988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(CCCN)C(=O)C4=CN=CC=C4)NC(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(CCCN)C(=O)C4=CN=CC=C4)NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C34H37N5O2/c35-16-8-20-39(34(41)30-13-7-17-36-24-30)25-27-11-6-12-28(21-27)29-14-15-32(38-18-4-5-19-38)31(23-29)37-33(40)22-26-9-2-1-3-10-26/h1-3,6-7,9-15,17,21,23-24H,4-5,8,16,18-20,22,25,35H2,(H,37,40)