(2S)-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-N,2-dimethyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide

Systemtic Name: (2S)-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-N,2-dimethyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Openeye Name: (2S)-N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-N,2-dimethyl-1-methylsulfonyl-indoline-5-carboxamide CAS Name: (2S)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,2-dimethyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide IUPAC Name: (2S)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-N,2-dimethyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Traditional Name: (2S)-N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-1-mesyl-N,2-dimethyl-indoline-5-carboxamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)N(C)CC(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

C[C@H]1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)N(C)CC(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C21H24BrN3O4S/c1-13-9-17(22)6-7-18(13)23-20(26)12-24(3)21(27)15-5-8-19-16(11-15)10-14(2)25(19)30(4,28)29/h5-9,11,14H,10,12H2,1-4H3,(H,23,26)/t14-/m0/s1