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

Systemtic Name: N-(3-azanylpropyl)-N-[[3-(3-benzamido-4-pyrrolidin-1-yl-phenyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: N-(3-aminopropyl)-N-[[3-(3-benzamido-4-pyrrolidin-1-yl-phenyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: N-(3-aminopropyl)-N-[[3-[3-benzamido-4-(1-pyrrolidinyl)phenyl]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-(3-aminopropyl)-N-[[3-(3-benzamido-4-pyrrolidin-1-ylphenyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-(3-aminopropyl)-N-[3-(3-benzamido-4-pyrrolidino-phenyl)benzyl]nicotinamide Formula: C33H35N5O2 MolecularWeight: 533.6633

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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)C5=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)C5=CC=CC=C5

InChI

InChI=1S/C33H35N5O2/c34-16-8-20-38(33(40)29-13-7-17-35-23-29)24-25-9-6-12-27(21-25)28-14-15-31(37-18-4-5-19-37)30(22-28)36-32(39)26-10-2-1-3-11-26/h1-3,6-7,9-15,17,21-23H,4-5,8,16,18-20,24,34H2,(H,36,39)