N-[3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]carbonylphenyl]pyridine-3-carboxamide

Systemtic Name: N-[3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]carbonylphenyl]pyridine-3-carboxamide Openeye Name: N-[3-[4-[(4-isopropylphenyl)methyl]piperazine-1-carbonyl]phenyl]pyridine-3-carboxamide CAS Name: N-[3-[oxo-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[4-[(4-propan-2-ylphenyl)methyl]piperazine-1-carbonyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[3-[4-(4-isopropylbenzyl)piperazine-1-carbonyl]phenyl]nicotinamide Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C27H30N4O2/c1-20(2)22-10-8-21(9-11-22)19-30-13-15-31(16-14-30)27(33)23-5-3-7-25(17-23)29-26(32)24-6-4-12-28-18-24/h3-12,17-18,20H,13-16,19H2,1-2H3,(H,29,32)