(3S)-4-(2,4-dichlorophenyl)carbonyl-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one

Systemtic Name: (3S)-4-(2,4-dichlorophenyl)carbonyl-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one Openeye Name: (3S)-4-(2,4-dichlorobenzoyl)-3-isobutyl-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one CAS Name: (3S)-4-[(2,4-dichlorophenyl)-oxomethyl]-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one IUPAC Name: (3S)-4-(2,4-dichlorobenzoyl)-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one Traditional Name: (3S)-4-(2,4-dichlorobenzoyl)-3-isobutyl-7-mesyl-1,3-dihydroquinoxalin-2-one Formula: C20H20Cl2N2O4S MolecularWeight: 455.3548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)NC2=C(N1C(=O)C3=C(C=C(C=C3)Cl)Cl)C=CC(=C2)S(=O)(=O)C

Isomeric SMILES

CC(C)C[C@H]1C(=O)NC2=C(N1C(=O)C3=C(C=C(C=C3)Cl)Cl)C=CC(=C2)S(=O)(=O)C

InChI

InChI=1S/C20H20Cl2N2O4S/c1-11(2)8-18-19(25)23-16-10-13(29(3,27)28)5-7-17(16)24(18)20(26)14-6-4-12(21)9-15(14)22/h4-7,9-11,18H,8H2,1-3H3,(H,23,25)/t18-/m0/s1