3-[(6-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-(3-phenylpropyl)propanamide

Systemtic Name: 3-[(6-methyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-(3-phenylpropyl)propanamide Openeye Name: 3-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-(3-phenylpropyl)propanamide CAS Name: 3-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-(3-phenylpropyl)propanamide IUPAC Name: 3-[(6-methyl-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-(3-phenylpropyl)propanamide Traditional Name: 3-[(3-keto-6-methyl-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-(3-phenylpropyl)propionamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)CCC(=O)NCCCC3=CC=CC=C3)OCC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)CCC(=O)NCCCC3=CC=CC=C3)OCC(=O)N2

InChI

InChI=1S/C21H24N2O5S/c1-15-12-17-18(28-14-21(25)23-17)13-19(15)29(26,27)11-9-20(24)22-10-5-8-16-6-3-2-4-7-16/h2-4,6-7,12-13H,5,8-11,14H2,1H3,(H,22,24)(H,23,25)