1-cyclohexyl-6-phenylmethoxy-4-(1,3-thiazol-4-ylcarbonyl)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-6-phenylmethoxy-4-(1,3-thiazol-4-ylcarbonyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-cyclohexyl-4-(thiazole-4-carbonyl)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[oxo(4-thiazolyl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-6-phenylmethoxy-4-(1,3-thiazole-4-carbonyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-cyclohexyl-4-(thiazole-4-carbonyl)-1,4-diazepan-2-one Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CSC=N3)OCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2CC(CN(CC2=O)C(=O)C3=CSC=N3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O3S/c26-21-13-24(22(27)20-15-29-16-23-20)11-19(28-14-17-7-3-1-4-8-17)12-25(21)18-9-5-2-6-10-18/h1,3-4,7-8,15-16,18-19H,2,5-6,9-14H2