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

Systemtic Name: 3-chloranyl-4-[4-[5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-3-phenyl-1,3-thiazolidin-2-ylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzenesulfonic acid Openeye Name: 3-chloro-4-[4-[5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-3-phenyl-thiazolidin-2-ylidene]-3-methyl-5-oxo-pyrazol-1-yl]benzenesulfonic acid CAS Name: 3-chloro-4-[4-[5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-3-phenyl-2-thiazolidinylidene]-3-methyl-5-oxo-1-pyrazolyl]benzenesulfonic acid IUPAC Name: 3-chloro-4-[4-[5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonic acid Traditional Name: 3-chloro-4-[5-keto-4-[4-keto-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-3-phenyl-thiazolidin-2-ylidene]-3-methyl-2-pyrazolin-1-yl]besylic acid Formula: C28H21ClN4O6S3 MolecularWeight: 641.13754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C2N(C(=O)C(=C3N(C4=C(S3)C=CC(=C4)OC)C)S2)C5=CC=CC=C5)C6=C(C=C(C=C6)S(=O)(=O)O)Cl

Isomeric SMILES

CC1=NN(C(=O)C1=C2N(C(=O)C(=C3N(C4=C(S3)C=CC(=C4)OC)C)S2)C5=CC=CC=C5)C6=C(C=C(C=C6)S(=O)(=O)O)Cl

InChI

InChI=1S/C28H21ClN4O6S3/c1-15-23(25(34)33(30-15)20-11-10-18(14-19(20)29)42(36,37)38)27-32(16-7-5-4-6-8-16)26(35)24(41-27)28-31(2)21-13-17(39-3)9-12-22(21)40-28/h4-14H,1-3H3,(H,36,37,38)