N-[[3-[3-acetamido-4-(4-methylpiperidin-1-yl)phenyl]phenyl]methyl]-N-(3-azanylpropyl)pyridine-3-carboxamide

Systemtic Name: N-[[3-[3-acetamido-4-(4-methylpiperidin-1-yl)phenyl]phenyl]methyl]-N-(3-azanylpropyl)pyridine-3-carboxamide Openeye Name: N-[[3-[3-acetamido-4-(4-methyl-1-piperidyl)phenyl]phenyl]methyl]-N-(3-aminopropyl)pyridine-3-carboxamide CAS Name: N-[[3-[3-acetamido-4-(4-methyl-1-piperidinyl)phenyl]phenyl]methyl]-N-(3-aminopropyl)-3-pyridinecarboxamide IUPAC Name: N-[[3-[3-acetamido-4-(4-methylpiperidin-1-yl)phenyl]phenyl]methyl]-N-(3-aminopropyl)pyridine-3-carboxamide Traditional Name: N-[3-[3-acetamido-4-(4-methylpiperidino)phenyl]benzyl]-N-(3-aminopropyl)nicotinamide Formula: C30H37N5O2 MolecularWeight: 499.64708

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(CCCN)C(=O)C4=CN=CC=C4)NC(=O)C

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C3=CC(=CC=C3)CN(CCCN)C(=O)C4=CN=CC=C4)NC(=O)C

InChI

InChI=1S/C30H37N5O2/c1-22-11-16-34(17-12-22)29-10-9-26(19-28(29)33-23(2)36)25-7-3-6-24(18-25)21-35(15-5-13-31)30(37)27-8-4-14-32-20-27/h3-4,6-10,14,18-20,22H,5,11-13,15-17,21,31H2,1-2H3,(H,33,36)