2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]-N-quinolin-5-yl-ethanamide

Systemtic Name: 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]-N-quinolin-5-yl-ethanamide Openeye Name: 2-[4-(3,5-dimethylisoxazol-4-yl)sulfonyl-1,4-diazepan-1-yl]-N-(5-quinolyl)acetamide CAS Name: 2-[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1,4-diazepan-1-yl]-N-(5-quinolinyl)acetamide IUPAC Name: 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]-N-quinolin-5-ylacetamide Traditional Name: 2-[4-(3,5-dimethylisoxazol-4-yl)sulfonyl-1,4-diazepan-1-yl]-N-(5-quinolyl)acetamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCN(CC2)CC(=O)NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCN(CC2)CC(=O)NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C21H25N5O4S/c1-15-21(16(2)30-24-15)31(28,29)26-11-5-10-25(12-13-26)14-20(27)23-19-8-3-7-18-17(19)6-4-9-22-18/h3-4,6-9H,5,10-14H2,1-2H3,(H,23,27)