3-[[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid

Systemtic Name: 3-[[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid Openeye Name: 3-[5-(2-methylthiazol-4-yl)indolin-1-yl]sulfonylbenzoic acid CAS Name: 3-[[5-(2-methyl-4-thiazolyl)-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid IUPAC Name: 3-[[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid Traditional Name: 3-[5-(2-methylthiazol-4-yl)indolin-1-yl]sulfonylbenzoic acid Formula: C19H16N2O4S2 MolecularWeight: 400.47134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C19H16N2O4S2/c1-12-20-17(11-26-12)13-5-6-18-14(9-13)7-8-21(18)27(24,25)16-4-2-3-15(10-16)19(22)23/h2-6,9-11H,7-8H2,1H3,(H,22,23)