2-methyl-N-[6-[4-(3-methyl-2-oxidanyl-butyl)piperazin-1-yl]pyridin-3-yl]benzamide

Systemtic Name: 2-methyl-N-[6-[4-(3-methyl-2-oxidanyl-butyl)piperazin-1-yl]pyridin-3-yl]benzamide Openeye Name: N-[6-[4-(2-hydroxy-3-methyl-butyl)piperazin-1-yl]-3-pyridyl]-2-methyl-benzamide CAS Name: N-[6-[4-(2-hydroxy-3-methylbutyl)-1-piperazinyl]-3-pyridinyl]-2-methylbenzamide IUPAC Name: N-[6-[4-(2-hydroxy-3-methylbutyl)piperazin-1-yl]pyridin-3-yl]-2-methylbenzamide Traditional Name: N-[6-[4-(2-hydroxy-3-methyl-butyl)piperazino]-3-pyridyl]-2-methyl-benzamide Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(C(C)C)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(C(C)C)O

InChI

InChI=1S/C22H30N4O2/c1-16(2)20(27)15-25-10-12-26(13-11-25)21-9-8-18(14-23-21)24-22(28)19-7-5-4-6-17(19)3/h4-9,14,16,20,27H,10-13,15H2,1-3H3,(H,24,28)