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

Systemtic Name: ethyl 4-[4-(4-tert-butylphenyl)-6-oxidanylidene-3-thiophen-2-yl-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Openeye Name: ethyl 4-[4-(4-tert-butylphenyl)-6-oxo-3-(2-thienyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate CAS Name: 4-[4-(4-tert-butylphenyl)-6-oxo-3-thiophen-2-yl-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-tert-butylphenyl)-6-oxo-3-thiophen-2-yl-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Traditional Name: 4-[4-(4-tert-butylphenyl)-6-keto-3-(2-thienyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C4=CC=CS4)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C4=CC=CS4)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C28H27N3O3S/c1-5-34-27(33)18-10-14-20(15-11-18)31-25(17-8-12-19(13-9-17)28(2,3)4)22-23(21-7-6-16-35-21)29-30-24(22)26(31)32/h6-16,25H,5H2,1-4H3,(H,29,30)