3-[2-[3-(4-methylphenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-3,4-dihydroquinolin-1-yl]propane-1-sulfonate

Systemtic Name: 3-[2-[3-(4-methylphenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-3,4-dihydroquinolin-1-yl]propane-1-sulfonate Openeye Name: 3-[2-[4-oxo-3-(p-tolyl)-2-thioxo-thiazolidin-5-ylidene]-3,4-dihydroquinolin-1-yl]propane-1-sulfonate CAS Name: 3-[2-[3-(4-methylphenyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]-3,4-dihydroquinolin-1-yl]-1-propanesulfonate IUPAC Name: 3-[2-[3-(4-methylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-3,4-dihydroquinolin-1-yl]propane-1-sulfonate Traditional Name: 3-[2-[4-keto-3-(p-tolyl)-2-thioxo-thiazolidin-5-ylidene]-3,4-dihydroquinolin-1-yl]propane-1-sulfonate Formula: C22H21N2O4S3- MolecularWeight: 473.60814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=C3CCC4=CC=CC=C4N3CCCS(=O)(=O)[O-])SC2=S

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(=C3CCC4=CC=CC=C4N3CCCS(=O)(=O)[O-])SC2=S

InChI

InChI=1S/C22H22N2O4S3/c1-15-7-10-17(11-8-15)24-21(25)20(30-22(24)29)19-12-9-16-5-2-3-6-18(16)23(19)13-4-14-31(26,27)28/h2-3,5-8,10-11H,4,9,12-14H2,1H3,(H,26,27,28)/p-1