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

Systemtic Name: (3S)-7-methylsulfonyl-3-(phenylmethyl)-4-propanoyl-1,3-dihydroquinoxalin-2-one Openeye Name: (3S)-3-benzyl-7-methylsulfonyl-4-propanoyl-1,3-dihydroquinoxalin-2-one CAS Name: (3S)-7-methylsulfonyl-4-(1-oxopropyl)-3-(phenylmethyl)-1,3-dihydroquinoxalin-2-one IUPAC Name: (3S)-3-benzyl-7-methylsulfonyl-4-propanoyl-1,3-dihydroquinoxalin-2-one Traditional Name: (3S)-3-benzyl-7-mesyl-4-propionyl-1,3-dihydroquinoxalin-2-one Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(C(=O)NC2=C1C=CC(=C2)S(=O)(=O)C)CC3=CC=CC=C3

Isomeric SMILES

CCC(=O)N1[C@H](C(=O)NC2=C1C=CC(=C2)S(=O)(=O)C)CC3=CC=CC=C3

InChI

InChI=1S/C19H20N2O4S/c1-3-18(22)21-16-10-9-14(26(2,24)25)12-15(16)20-19(23)17(21)11-13-7-5-4-6-8-13/h4-10,12,17H,3,11H2,1-2H3,(H,20,23)/t17-/m0/s1