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

Systemtic Name: (3S)-3-(2-methylpropyl)-7-methylsulfonyl-4-propanoyl-1,3-dihydroquinoxalin-2-one Openeye Name: (3S)-3-isobutyl-7-methylsulfonyl-4-propanoyl-1,3-dihydroquinoxalin-2-one CAS Name: (3S)-3-(2-methylpropyl)-7-methylsulfonyl-4-(1-oxopropyl)-1,3-dihydroquinoxalin-2-one IUPAC Name: (3S)-3-(2-methylpropyl)-7-methylsulfonyl-4-propanoyl-1,3-dihydroquinoxalin-2-one Traditional Name: (3S)-3-isobutyl-7-mesyl-4-propionyl-1,3-dihydroquinoxalin-2-one Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(C(=O)NC2=C1C=CC(=C2)S(=O)(=O)C)CC(C)C

Isomeric SMILES

CCC(=O)N1[C@H](C(=O)NC2=C1C=CC(=C2)S(=O)(=O)C)CC(C)C

InChI

InChI=1S/C16H22N2O4S/c1-5-15(19)18-13-7-6-11(23(4,21)22)9-12(13)17-16(20)14(18)8-10(2)3/h6-7,9-10,14H,5,8H2,1-4H3,(H,17,20)/t14-/m0/s1