5-(4-bromophenyl)-3-(4-methoxyphenyl)-4-thiophen-2-yl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one

Systemtic Name: 5-(4-bromophenyl)-3-(4-methoxyphenyl)-4-thiophen-2-yl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Openeye Name: 5-(4-bromophenyl)-3-(4-methoxyphenyl)-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one CAS Name: 5-(4-bromophenyl)-3-(4-methoxyphenyl)-4-thiophen-2-yl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one IUPAC Name: 5-(4-bromophenyl)-3-(4-methoxyphenyl)-4-thiophen-2-yl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Traditional Name: 5-(4-bromophenyl)-3-(4-methoxyphenyl)-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Formula: C22H16BrN3O2S MolecularWeight: 466.35034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC3=C2C(N(C3=O)C4=CC=C(C=C4)Br)C5=CC=CS5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC3=C2C(N(C3=O)C4=CC=C(C=C4)Br)C5=CC=CS5

InChI

InChI=1S/C22H16BrN3O2S/c1-28-16-10-4-13(5-11-16)19-18-20(25-24-19)22(27)26(15-8-6-14(23)7-9-15)21(18)17-3-2-12-29-17/h2-12,21H,1H3,(H,24,25)