6-[[4-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[[4-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[[4-(2-indolin-1-yl-2-oxo-ethyl)sulfanylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[4-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]anilino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[[4-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[[4-[(2-indolin-1-yl-2-keto-ethyl)thio]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C24H24N2O4S MolecularWeight: 436.52336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(=O)CSC3=CC=C(C=C3)NC(=O)C4CC=CCC4C(=O)O

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(=O)CSC3=CC=C(C=C3)NC(=O)C4CC=CCC4C(=O)O

InChI

InChI=1S/C24H24N2O4S/c27-22(26-14-13-16-5-1-4-8-21(16)26)15-31-18-11-9-17(10-12-18)25-23(28)19-6-2-3-7-20(19)24(29)30/h1-5,8-12,19-20H,6-7,13-15H2,(H,25,28)(H,29,30)