5-(1,3-benzodioxol-5-ylmethylidene)-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylidene)-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-(1,3-benzodioxol-5-ylmethylene)-3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-thioxo-thiazolidin-4-one CAS Name: 5-(1,3-benzodioxol-5-ylmethylidene)-3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylidene)-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-5-piperonylidene-2-thioxo-thiazolidin-4-one Formula: C22H17N3O4S2 MolecularWeight: 451.51808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C(=CC4=CC5=C(C=C4)OCO5)SC3=S

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C(=CC4=CC5=C(C=C4)OCO5)SC3=S

InChI

InChI=1S/C22H17N3O4S2/c1-13-19(21(27)25(23(13)2)15-6-4-3-5-7-15)24-20(26)18(31-22(24)30)11-14-8-9-16-17(10-14)29-12-28-16/h3-11H,12H2,1-2H3