4-[2-(benzimidazol-1-yl)ethanoyl]-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-[2-(benzimidazol-1-yl)ethanoyl]-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 4-[2-(benzimidazol-1-yl)acetyl]-6-methoxy-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-[2-(1-benzimidazolyl)-1-oxoethyl]-6-methoxy-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-[2-(benzimidazol-1-yl)acetyl]-6-methoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 4-[2-(benzimidazol-1-yl)acetyl]-6-methoxy-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CC(=O)N(C1)CC2=CN=CC=C2)C(=O)CN3C=NC4=CC=CC=C43

Isomeric SMILES

COC1CN(CC(=O)N(C1)CC2=CN=CC=C2)C(=O)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C21H23N5O3/c1-29-17-11-24(10-16-5-4-8-22-9-16)20(27)13-25(12-17)21(28)14-26-15-23-18-6-2-3-7-19(18)26/h2-9,15,17H,10-14H2,1H3