1-cyclohexyl-4-[(2-methyl-1,3-thiazol-4-yl)carbonyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-[(2-methyl-1,3-thiazol-4-yl)carbonyl]-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-4-(2-methylthiazole-4-carbonyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[(2-methyl-4-thiazolyl)-oxomethyl]-6-(3-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(2-methyl-1,3-thiazole-4-carbonyl)-6-(pyridin-3-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-4-(2-methylthiazole-4-carbonyl)-6-(3-pyridylmethoxy)-1,4-diazepan-2-one Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CN=CC=C4

Isomeric SMILES

CC1=NC(=CS1)C(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CN=CC=C4

InChI

InChI=1S/C22H28N4O3S/c1-16-24-20(15-30-16)22(28)25-11-19(29-14-17-6-5-9-23-10-17)12-26(21(27)13-25)18-7-3-2-4-8-18/h5-6,9-10,15,18-19H,2-4,7-8,11-14H2,1H3