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

Systemtic Name: 4-methyl-3-[[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid Openeye Name: 4-methyl-3-[5-(2-methylthiazol-4-yl)indolin-1-yl]sulfonyl-benzoic acid CAS Name: 4-methyl-3-[[5-(2-methyl-4-thiazolyl)-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid IUPAC Name: 4-methyl-3-[[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]sulfonyl]benzoic acid Traditional Name: 4-methyl-3-[5-(2-methylthiazol-4-yl)indolin-1-yl]sulfonyl-benzoic acid Formula: C20H18N2O4S2 MolecularWeight: 414.49792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)C

InChI

InChI=1S/C20H18N2O4S2/c1-12-3-4-16(20(23)24)10-19(12)28(25,26)22-8-7-15-9-14(5-6-18(15)22)17-11-27-13(2)21-17/h3-6,9-11H,7-8H2,1-2H3,(H,23,24)