4-[5-[(Z)-[3-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid

Systemtic Name: 4-[5-[(Z)-[3-(4-methylpiperazin-1-yl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid Openeye Name: 4-[5-[(Z)-[3-(4-methylpiperazin-1-yl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-2-furyl]benzoic acid CAS Name: 4-[5-[(Z)-[3-(4-methyl-1-piperazinyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-2-furanyl]benzoic acid IUPAC Name: 4-[5-[(Z)-[3-(4-methylpiperazin-1-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid Traditional Name: 4-[5-[(Z)-[4-keto-3-(4-methylpiperazino)-2-thioxo-thiazolidin-5-ylidene]methyl]-2-furyl]benzoic acid Formula: C20H19N3O4S2 MolecularWeight: 429.51256

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)C(=O)O)SC2=S

Isomeric SMILES

CN1CCN(CC1)N2C(=O)/C(=C/C3=CC=C(O3)C4=CC=C(C=C4)C(=O)O)/SC2=S

InChI

InChI=1S/C20H19N3O4S2/c1-21-8-10-22(11-9-21)23-18(24)17(29-20(23)28)12-15-6-7-16(27-15)13-2-4-14(5-3-13)19(25)26/h2-7,12H,8-11H2,1H3,(H,25,26)/b17-12-