4-[(1-methylindol-3-yl)methyl]-6-oxidanyl-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-[(1-methylindol-3-yl)methyl]-6-oxidanyl-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-hydroxy-4-[(1-methylindol-3-yl)methyl]-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 6-hydroxy-4-[(1-methyl-3-indolyl)methyl]-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-hydroxy-4-[(1-methylindol-3-yl)methyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-hydroxy-4-[(1-methylindol-3-yl)methyl]-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CN3CC(CN(C(=O)C3)CC4=CN=CC=C4)O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CN3CC(CN(C(=O)C3)CC4=CN=CC=C4)O

InChI

InChI=1S/C21H24N4O2/c1-23-11-17(19-6-2-3-7-20(19)23)12-24-13-18(26)14-25(21(27)15-24)10-16-5-4-8-22-9-16/h2-9,11,18,26H,10,12-15H2,1H3