N-[2-(3,4-dimethylphenyl)sulfanylethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-2-methyl-1-methylsulfonyl-indoline-5-carboxamide CAS Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Traditional Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-1-mesyl-2-methyl-indoline-5-carboxamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NCCSC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NCCSC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H26N2O3S2/c1-14-5-7-19(11-15(14)2)27-10-9-22-21(24)17-6-8-20-18(13-17)12-16(3)23(20)28(4,25)26/h5-8,11,13,16H,9-10,12H2,1-4H3,(H,22,24)