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

Systemtic Name: (3S)-4-(2-methylphenyl)carbonyl-7-methylsulfonyl-3-(phenylmethyl)-1,3-dihydroquinoxalin-2-one Openeye Name: (3S)-3-benzyl-4-(2-methylbenzoyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one CAS Name: (3S)-4-[(2-methylphenyl)-oxomethyl]-7-methylsulfonyl-3-(phenylmethyl)-1,3-dihydroquinoxalin-2-one IUPAC Name: (3S)-3-benzyl-4-(2-methylbenzoyl)-7-methylsulfonyl-1,3-dihydroquinoxalin-2-one Traditional Name: (3S)-3-benzyl-7-mesyl-4-o-toluoyl-1,3-dihydroquinoxalin-2-one Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2C(C(=O)NC3=C2C=CC(=C3)S(=O)(=O)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2[C@H](C(=O)NC3=C2C=CC(=C3)S(=O)(=O)C)CC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O4S/c1-16-8-6-7-11-19(16)24(28)26-21-13-12-18(31(2,29)30)15-20(21)25-23(27)22(26)14-17-9-4-3-5-10-17/h3-13,15,22H,14H2,1-2H3,(H,25,27)/t22-/m0/s1