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

Systemtic Name: 4-[(1-methylbenzimidazol-2-yl)methyl]-6-oxidanyl-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-hydroxy-4-[(1-methylbenzimidazol-2-yl)methyl]-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 6-hydroxy-4-[(1-methyl-2-benzimidazolyl)methyl]-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-hydroxy-4-[(1-methylbenzimidazol-2-yl)methyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-hydroxy-4-[(1-methylbenzimidazol-2-yl)methyl]-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1CN3CC(CN(C(=O)C3)CC4=CN=CC=C4)O

Isomeric SMILES

CN1C2=CC=CC=C2N=C1CN3CC(CN(C(=O)C3)CC4=CN=CC=C4)O

InChI

InChI=1S/C20H23N5O2/c1-23-18-7-3-2-6-17(18)22-19(23)13-24-11-16(26)12-25(20(27)14-24)10-15-5-4-8-21-9-15/h2-9,16,26H,10-14H2,1H3