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

Systemtic Name: 4-methyl-N-[6-[4-(2-oxidanyl-3-phenylmethoxy-propyl)piperazin-1-yl]pyridin-3-yl]benzamide Openeye Name: N-[6-[4-(3-benzyloxy-2-hydroxy-propyl)piperazin-1-yl]-3-pyridyl]-4-methyl-benzamide CAS Name: N-[6-[4-(2-hydroxy-3-phenylmethoxypropyl)-1-piperazinyl]-3-pyridinyl]-4-methylbenzamide IUPAC Name: N-[6-[4-(2-hydroxy-3-phenylmethoxypropyl)piperazin-1-yl]pyridin-3-yl]-4-methylbenzamide Traditional Name: N-[6-[4-(3-benzoxy-2-hydroxy-propyl)piperazino]-3-pyridyl]-4-methyl-benzamide Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COCC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COCC4=CC=CC=C4)O

InChI

InChI=1S/C27H32N4O3/c1-21-7-9-23(10-8-21)27(33)29-24-11-12-26(28-17-24)31-15-13-30(14-16-31)18-25(32)20-34-19-22-5-3-2-4-6-22/h2-12,17,25,32H,13-16,18-20H2,1H3,(H,29,33)