3-[4-(3-chlorophenyl)-7-methyl-1,8-naphthyridin-3-yl]-5-oxidanylidene-hexane-3-sulfonamide

Systemtic Name: 3-[4-(3-chlorophenyl)-7-methyl-1,8-naphthyridin-3-yl]-5-oxidanylidene-hexane-3-sulfonamide Openeye Name: 3-[4-(3-chlorophenyl)-7-methyl-1,8-naphthyridin-3-yl]-5-oxo-hexane-3-sulfonamide CAS Name: 3-[4-(3-chlorophenyl)-7-methyl-1,8-naphthyridin-3-yl]-5-oxo-3-hexanesulfonamide IUPAC Name: 3-[4-(3-chlorophenyl)-7-methyl-1,8-naphthyridin-3-yl]-5-oxohexane-3-sulfonamide Traditional Name: 3-[4-(3-chlorophenyl)-7-methyl-1,8-naphthyridin-3-yl]-5-keto-hexane-3-sulfonamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)C)(C1=CN=C2C(=C1C3=CC(=CC=C3)Cl)C=CC(=N2)C)S(=O)(=O)N

Isomeric SMILES

CCC(CC(=O)C)(C1=CN=C2C(=C1C3=CC(=CC=C3)Cl)C=CC(=N2)C)S(=O)(=O)N

InChI

InChI=1S/C21H22ClN3O3S/c1-4-21(11-14(3)26,29(23,27)28)18-12-24-20-17(9-8-13(2)25-20)19(18)15-6-5-7-16(22)10-15/h5-10,12H,4,11H2,1-3H3,(H2,23,27,28)