3-methyl-4-[3-methyl-4-[5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]-5-oxidanylidene-pyrazol-1-yl]benzenesulfonic acid

Systemtic Name: 3-methyl-4-[3-methyl-4-[5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]-5-oxidanylidene-pyrazol-1-yl]benzenesulfonic acid Openeye Name: 4-[4-[3-allyl-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-thiazolidin-2-ylidene]-3-methyl-5-oxo-pyrazol-1-yl]-3-methyl-benzenesulfonic acid CAS Name: 3-methyl-4-[3-methyl-4-[5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-3-prop-2-enyl-2-thiazolidinylidene]-5-oxo-1-pyrazolyl]benzenesulfonic acid IUPAC Name: 3-methyl-4-[3-methyl-4-[5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]-5-oxopyrazol-1-yl]benzenesulfonic acid Traditional Name: 4-[4-[3-allyl-4-keto-5-(3-methyl-1,3-benzothiazol-2-ylidene)thiazolidin-2-ylidene]-5-keto-3-methyl-2-pyrazolin-1-yl]-3-methyl-besylic acid Formula: C25H22N4O5S3 MolecularWeight: 554.66098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)O)N2C(=O)C(=C3N(C(=O)C(=C4N(C5=CC=CC=C5S4)C)S3)CC=C)C(=N2)C

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)O)N2C(=O)C(=C3N(C(=O)C(=C4N(C5=CC=CC=C5S4)C)S3)CC=C)C(=N2)C

InChI

InChI=1S/C25H22N4O5S3/c1-5-12-28-23(31)21(25-27(4)18-8-6-7-9-19(18)35-25)36-24(28)20-15(3)26-29(22(20)30)17-11-10-16(13-14(17)2)37(32,33)34/h5-11,13H,1,12H2,2-4H3,(H,32,33,34)