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

Systemtic Name: 1-(oxan-4-ylmethyl)-6-phenylmethoxy-4-(1,3-thiazol-4-ylcarbonyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-(tetrahydropyran-4-ylmethyl)-4-(thiazole-4-carbonyl)-1,4-diazepan-2-one CAS Name: 1-(4-oxanylmethyl)-4-[oxo(4-thiazolyl)methyl]-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 1-(oxan-4-ylmethyl)-6-phenylmethoxy-4-(1,3-thiazole-4-carbonyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-(tetrahydropyran-4-ylmethyl)-4-(thiazole-4-carbonyl)-1,4-diazepan-2-one Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CN2CC(CN(CC2=O)C(=O)C3=CSC=N3)OCC4=CC=CC=C4

Isomeric SMILES

C1COCCC1CN2CC(CN(CC2=O)C(=O)C3=CSC=N3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O4S/c26-21-13-25(22(27)20-15-30-16-23-20)12-19(29-14-18-4-2-1-3-5-18)11-24(21)10-17-6-8-28-9-7-17/h1-5,15-17,19H,6-14H2