4-[(2S)-2-(2-bromophenyl)sulfanylpropanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[(2S)-2-(2-bromophenyl)sulfanylpropanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[(2S)-2-(2-bromophenyl)sulfanylpropanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[(2S)-2-[(2-bromophenyl)thio]-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[(2S)-2-(2-bromophenyl)sulfanylpropanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[(2S)-2-[(2-bromophenyl)thio]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C19H19BrN2O2S MolecularWeight: 419.33536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=CC=CC=C3Br

Isomeric SMILES

C[C@@H](C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SC3=CC=CC=C3Br

InChI

InChI=1S/C19H19BrN2O2S/c1-12(25-16-11-7-4-8-13(16)20)17(23)22-15-10-6-5-9-14(15)21-18(24)19(22,2)3/h4-12H,1-3H3,(H,21,24)/t12-/m0/s1