(3S)-3-[(2S)-butan-2-yl]-7-methylsulfonyl-4-propanoyl-1,3-dihydroquinoxalin-2-one

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4S/c1-5-10(3)15-16(20)17-12-9-11(23(4,21)22)7-8-13(12)18(15)14(19)6-2/h7-10,15H,5-6H2,1-4H3,(H,17,20)/t10-,15-/m0/s1