(2-methyl-1,3-thiazol-4-yl)methyl 3-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoate

Systemtic Name: (2-methyl-1,3-thiazol-4-yl)methyl 3-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoate Openeye Name: (2-methylthiazol-4-yl)methyl 3-[(2S)-2-methylindolin-1-yl]sulfonylbenzoate CAS Name: 3-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid (2-methyl-4-thiazolyl)methyl ester IUPAC Name: (2-methyl-1,3-thiazol-4-yl)methyl 3-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoate Traditional Name: 3-[(2S)-2-methylindolin-1-yl]sulfonylbenzoic acid (2-methylthiazol-4-yl)methyl ester Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC4=CSC(=N4)C

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC4=CSC(=N4)C

InChI

InChI=1S/C21H20N2O4S2/c1-14-10-16-6-3-4-9-20(16)23(14)29(25,26)19-8-5-7-17(11-19)21(24)27-12-18-13-28-15(2)22-18/h3-9,11,13-14H,10,12H2,1-2H3/t14-/m0/s1