7-chloranyl-N-(2,4-dimethylpentan-3-yl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide

Systemtic Name: 7-chloranyl-N-(2,4-dimethylpentan-3-yl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Openeye Name: 7-chloro-N-(1-isopropyl-2-methyl-propyl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide CAS Name: 7-chloro-N-(2,4-dimethylpentan-3-yl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide IUPAC Name: 7-chloro-N-(2,4-dimethylpentan-3-yl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Traditional Name: 7-chloro-N-(1-isopropyl-2-methyl-propyl)-5-mesyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Formula: C18H27ClN2O4S MolecularWeight: 402.93598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)NC(=O)C1CCN(C2=C(O1)C=CC(=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C)C(C(C)C)NC(=O)C1CCN(C2=C(O1)C=CC(=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C18H27ClN2O4S/c1-11(2)17(12(3)4)20-18(22)16-8-9-21(26(5,23)24)14-10-13(19)6-7-15(14)25-16/h6-7,10-12,16-17H,8-9H2,1-5H3,(H,20,22)