4-methyl-N-[6-[4-(2-oxidanyl-2-phenyl-ethyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide

Systemtic Name: 4-methyl-N-[6-[4-(2-oxidanyl-2-phenyl-ethyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Openeye Name: N-[6-[4-(2-hydroxy-2-phenyl-ethyl)-1,4-diazepan-1-yl]-3-pyridyl]-4-methyl-benzamide CAS Name: N-[6-[4-(2-hydroxy-2-phenylethyl)-1,4-diazepan-1-yl]-3-pyridinyl]-4-methylbenzamide IUPAC Name: N-[6-[4-(2-hydroxy-2-phenylethyl)-1,4-diazepan-1-yl]pyridin-3-yl]-4-methylbenzamide Traditional Name: N-[6-[4-(2-hydroxy-2-phenyl-ethyl)-1,4-diazepan-1-yl]-3-pyridyl]-4-methyl-benzamide Formula: C26H30N4O2 MolecularWeight: 430.542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)CC(C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)CC(C4=CC=CC=C4)O

InChI

InChI=1S/C26H30N4O2/c1-20-8-10-22(11-9-20)26(32)28-23-12-13-25(27-18-23)30-15-5-14-29(16-17-30)19-24(31)21-6-3-2-4-7-21/h2-4,6-13,18,24,31H,5,14-17,19H2,1H3,(H,28,32)