N-(2-methyl-5-methylsulfonyl-phenyl)-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-(2-methyl-5-methylsulfonyl-phenyl)-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-(2-methyl-5-methylsulfonyl-phenyl)-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-(2-methyl-5-methylsulfonylphenyl)-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-(2-methyl-5-methylsulfonylphenyl)-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)-N-(5-mesyl-2-methyl-phenyl)propionamide Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CCN2C(=O)COC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CCN2C(=O)COC3=CC=CC=C32

InChI

InChI=1S/C19H20N2O5S/c1-13-7-8-14(27(2,24)25)11-15(13)20-18(22)9-10-21-16-5-3-4-6-17(16)26-12-19(21)23/h3-8,11H,9-10,12H2,1-2H3,(H,20,22)