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

Systemtic Name: N-(3-azanylpropyl)-N-[[3-[3-(cyclopropylcarbonylamino)-4-pyrrolidin-1-yl-phenyl]phenyl]methyl]pyridine-3-carboxamide Openeye Name: N-(3-aminopropyl)-N-[[3-[3-(cyclopropanecarbonylamino)-4-pyrrolidin-1-yl-phenyl]phenyl]methyl]pyridine-3-carboxamide CAS Name: N-(3-aminopropyl)-N-[[3-[3-[[cyclopropyl(oxo)methyl]amino]-4-(1-pyrrolidinyl)phenyl]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-(3-aminopropyl)-N-[[3-[3-(cyclopropanecarbonylamino)-4-pyrrolidin-1-ylphenyl]phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-(3-aminopropyl)-N-[3-[3-(cyclopropanecarbonylamino)-4-pyrrolidino-phenyl]benzyl]nicotinamide Formula: C30H35N5O2 MolecularWeight: 497.6312

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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)C5CC5

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(CCCN)C(=O)C4=CN=CC=C4)NC(=O)C5CC5

InChI

InChI=1S/C30H35N5O2/c31-13-5-17-35(30(37)26-8-4-14-32-20-26)21-22-6-3-7-24(18-22)25-11-12-28(34-15-1-2-16-34)27(19-25)33-29(36)23-9-10-23/h3-4,6-8,11-12,14,18-20,23H,1-2,5,9-10,13,15-17,21,31H2,(H,33,36)