(2S)-N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide

Systemtic Name: (2S)-N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Openeye Name: (2S)-N-[2-(2,3-dimethylanilino)-2-oxo-ethyl]-2-methyl-1-methylsulfonyl-indoline-5-carboxamide CAS Name: (2S)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide IUPAC Name: (2S)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Traditional Name: (2S)-N-[2-(2,3-dimethylanilino)-2-keto-ethyl]-1-mesyl-2-methyl-indoline-5-carboxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NCC(=O)NC3=CC=CC(=C3C)C

Isomeric SMILES

C[C@H]1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NCC(=O)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C21H25N3O4S/c1-13-6-5-7-18(15(13)3)23-20(25)12-22-21(26)16-8-9-19-17(11-16)10-14(2)24(19)29(4,27)28/h5-9,11,14H,10,12H2,1-4H3,(H,22,26)(H,23,25)/t14-/m0/s1