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

Systemtic Name: N-(3-azanylpropyl)-N-[[3-[3-(cyclobutylcarbonylamino)-4-pyrrolidin-1-yl-phenyl]phenyl]methyl]pyridine-3-carboxamide Openeye Name: N-(3-aminopropyl)-N-[[3-[3-(cyclobutanecarbonylamino)-4-pyrrolidin-1-yl-phenyl]phenyl]methyl]pyridine-3-carboxamide CAS Name: N-(3-aminopropyl)-N-[[3-[3-[[cyclobutyl(oxo)methyl]amino]-4-(1-pyrrolidinyl)phenyl]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-(3-aminopropyl)-N-[[3-[3-(cyclobutanecarbonylamino)-4-pyrrolidin-1-ylphenyl]phenyl]methyl]pyridine-3-carboxamide Traditional Name: N-(3-aminopropyl)-N-[3-[3-(cyclobutanecarbonylamino)-4-pyrrolidino-phenyl]benzyl]nicotinamide Formula: C31H37N5O2 MolecularWeight: 511.65778

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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)C5CCC5

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(CCCN)C(=O)C4=CN=CC=C4)NC(=O)C5CCC5

InChI

InChI=1S/C31H37N5O2/c32-14-6-18-36(31(38)27-11-5-15-33-21-27)22-23-7-3-10-25(19-23)26-12-13-29(35-16-1-2-17-35)28(20-26)34-30(37)24-8-4-9-24/h3,5,7,10-13,15,19-21,24H,1-2,4,6,8-9,14,16-18,22,32H2,(H,34,37)