3-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[4-(diethylamino)-2-methyl-phenyl]propanamide

Systemtic Name: 3-[(6-chloranyl-3-oxidanylidene-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[4-(diethylamino)-2-methyl-phenyl]propanamide Openeye Name: 3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[4-(diethylamino)-2-methyl-phenyl]propanamide CAS Name: 3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[4-(diethylamino)-2-methylphenyl]propanamide IUPAC Name: 3-[(6-chloro-3-oxo-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[4-(diethylamino)-2-methylphenyl]propanamide Traditional Name: 3-[(6-chloro-3-keto-4H-1,4-benzoxazin-7-yl)sulfonyl]-N-[4-(diethylamino)-2-methyl-phenyl]propionamide Formula: C22H26ClN3O5S MolecularWeight: 479.97694

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC(=O)CCS(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl)C

InChI

InChI=1S/C22H26ClN3O5S/c1-4-26(5-2)15-6-7-17(14(3)10-15)24-21(27)8-9-32(29,30)20-12-19-18(11-16(20)23)25-22(28)13-31-19/h6-7,10-12H,4-5,8-9,13H2,1-3H3,(H,24,27)(H,25,28)