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

Systemtic Name: (3S)-4-(3-methylbutanoyl)-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one Openeye Name: (3S)-3-isobutyl-4-(3-methylbutanoyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one CAS Name: (3S)-4-(3-methyl-1-oxobutyl)-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one IUPAC Name: (3S)-4-(3-methylbutanoyl)-3-(2-methylpropyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one Traditional Name: (3S)-3-isobutyl-4-isovaleryl-7-mesyl-1,3-dihydroquinoxalin-2-one Formula: C18H26N2O4S MolecularWeight: 366.47504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O4S/c1-11(2)8-16-18(22)19-14-10-13(25(5,23)24)6-7-15(14)20(16)17(21)9-12(3)4/h6-7,10-12,16H,8-9H2,1-5H3,(H,19,22)/t16-/m0/s1