ethyl 4-[3-(4-methylphenyl)-6-oxidanylidene-4-thiophen-2-yl-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate

Systemtic Name: ethyl 4-[3-(4-methylphenyl)-6-oxidanylidene-4-thiophen-2-yl-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Openeye Name: ethyl 4-[6-oxo-3-(p-tolyl)-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate CAS Name: 4-[3-(4-methylphenyl)-6-oxo-4-thiophen-2-yl-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-methylphenyl)-6-oxo-4-thiophen-2-yl-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Traditional Name: 4-[6-keto-3-(p-tolyl)-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(C3=C(C2=O)NN=C3C4=CC=C(C=C4)C)C5=CC=CS5

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(C3=C(C2=O)NN=C3C4=CC=C(C=C4)C)C5=CC=CS5

InChI

InChI=1S/C25H21N3O3S/c1-3-31-25(30)17-10-12-18(13-11-17)28-23(19-5-4-14-32-19)20-21(26-27-22(20)24(28)29)16-8-6-15(2)7-9-16/h4-14,23H,3H2,1-2H3,(H,26,27)