6-(cyclopropylmethoxy)-4-(2-methylpyridin-3-yl)carbonyl-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 6-(cyclopropylmethoxy)-4-(2-methylpyridin-3-yl)carbonyl-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-(cyclopropylmethoxy)-4-(2-methylpyridine-3-carbonyl)-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 6-(cyclopropylmethoxy)-4-[(2-methyl-3-pyridinyl)-oxomethyl]-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-(cyclopropylmethoxy)-4-(2-methylpyridine-3-carbonyl)-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-(cyclopropylmethoxy)-4-(2-methylnicotinoyl)-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)C(=O)N2CC(CN(C(=O)C2)CC3=CN=CC=C3)OCC4CC4

Isomeric SMILES

CC1=C(C=CC=N1)C(=O)N2CC(CN(C(=O)C2)CC3=CN=CC=C3)OCC4CC4

InChI

InChI=1S/C22H26N4O3/c1-16-20(5-3-9-24-16)22(28)26-13-19(29-15-17-6-7-17)12-25(21(27)14-26)11-18-4-2-8-23-10-18/h2-5,8-10,17,19H,6-7,11-15H2,1H3