3-[2-(1,3-benzothiazol-2-yl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-[2-(1,3-benzothiazol-2-yl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione Openeye Name: 3-[2-(1,3-benzothiazol-2-yl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione CAS Name: 3-[2-(1,3-benzothiazol-2-yl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[2-(1,3-benzothiazol-2-yl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-dione Traditional Name: 3-[1-(1,3-benzothiazol-2-yl)-5-keto-3-methyl-3-pyrazolin-4-yl]-1-(3-methoxyphenyl)pyrrolidine-2,5-quinone Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3S2)C4CC(=O)N(C4=O)C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3S2)C4CC(=O)N(C4=O)C5=CC(=CC=C5)OC

InChI

InChI=1S/C22H18N4O4S/c1-12-19(21(29)26(24-12)22-23-16-8-3-4-9-17(16)31-22)15-11-18(27)25(20(15)28)13-6-5-7-14(10-13)30-2/h3-10,15,24H,11H2,1-2H3