(2S)-2-methyl-1-methylsulfonyl-N-[2-(thiophen-2-ylsulfonylamino)phenyl]-2,3-dihydroindole-5-carboximidate

Systemtic Name: (2S)-2-methyl-1-methylsulfonyl-N-[2-(thiophen-2-ylsulfonylamino)phenyl]-2,3-dihydroindole-5-carboximidate Openeye Name: (2S)-2-methyl-1-methylsulfonyl-N-[2-(2-thienylsulfonylamino)phenyl]indoline-5-carboximidate CAS Name: (2S)-2-methyl-1-methylsulfonyl-N-[2-(thiophen-2-ylsulfonylamino)phenyl]-2,3-dihydroindole-5-carboximidate IUPAC Name: (2S)-2-methyl-1-methylsulfonyl-N-[2-(thiophen-2-ylsulfonylamino)phenyl]-2,3-dihydroindole-5-carboximidate Traditional Name: (2S)-1-mesyl-2-methyl-N-[2-(2-thienylsulfonylamino)phenyl]indoline-5-carboximidate Formula: C21H20N3O5S3- MolecularWeight: 490.5956

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=NC3=CC=CC=C3NS(=O)(=O)C4=CC=CS4)[O-]

Isomeric SMILES

C[C@H]1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=NC3=CC=CC=C3NS(=O)(=O)C4=CC=CS4)[O-]

InChI

InChI=1S/C21H21N3O5S3/c1-14-12-16-13-15(9-10-19(16)24(14)31(2,26)27)21(25)22-17-6-3-4-7-18(17)23-32(28,29)20-8-5-11-30-20/h3-11,13-14,23H,12H2,1-2H3,(H,22,25)/p-1/t14-/m0/s1