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

Systemtic Name: (3S)-3-[(2S)-butan-2-yl]-7-methylsulfonyl-4-(phenylcarbonyl)-1,3-dihydroquinoxalin-2-one Openeye Name: (3S)-4-benzoyl-3-[(1S)-1-methylpropyl]-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one CAS Name: (3S)-4-benzoyl-3-[(2S)-butan-2-yl]-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one IUPAC Name: (3S)-4-benzoyl-3-[(2S)-butan-2-yl]-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one Traditional Name: (3S)-4-benzoyl-7-mesyl-3-[(1S)-1-methylpropyl]-1,3-dihydroquinoxalin-2-one Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)NC2=C(N1C(=O)C3=CC=CC=C3)C=CC(=C2)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4S/c1-4-13(2)18-19(23)21-16-12-15(27(3,25)26)10-11-17(16)22(18)20(24)14-8-6-5-7-9-14/h5-13,18H,4H2,1-3H3,(H,21,23)/t13-,18-/m0/s1