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

Systemtic Name: (3S)-4-(4-chlorophenyl)carbonyl-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one Openeye Name: (3S)-4-(4-chlorobenzoyl)-3-isobutyl-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one CAS Name: (3S)-4-[(4-chlorophenyl)-oxomethyl]-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one IUPAC Name: (3S)-4-(4-chlorobenzoyl)-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one Traditional Name: (3S)-4-(4-chlorobenzoyl)-3-isobutyl-7-mesyl-1,3-dihydroquinoxalin-2-one Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN2O4S/c1-12(2)10-18-19(24)22-16-11-15(28(3,26)27)8-9-17(16)23(18)20(25)13-4-6-14(21)7-5-13/h4-9,11-12,18H,10H2,1-3H3,(H,22,24)/t18-/m0/s1