6-methyl-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]pyridine-3-carboxamide

Systemtic Name: 6-methyl-N-[4-[[4-(phenylmethyl)piperazin-1-yl]methyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-6-methyl-pyridine-3-carboxamide CAS Name: 6-methyl-N-[4-[[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-6-methylpyridine-3-carboxamide Traditional Name: N-[4-[(4-benzylpiperazino)methyl]phenyl]-6-methyl-nicotinamide Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O/c1-20-7-10-23(17-26-20)25(30)27-24-11-8-22(9-12-24)19-29-15-13-28(14-16-29)18-21-5-3-2-4-6-21/h2-12,17H,13-16,18-19H2,1H3,(H,27,30)