1-methyl-3-(4-methylphenyl)-5-(phenylmethyl)-4-(4-propoxyphenyl)-4H-pyrrolo[3,4-c]pyrazol-6-one

Systemtic Name: 1-methyl-3-(4-methylphenyl)-5-(phenylmethyl)-4-(4-propoxyphenyl)-4H-pyrrolo[3,4-c]pyrazol-6-one Openeye Name: 5-benzyl-1-methyl-4-(4-propoxyphenyl)-3-(p-tolyl)-4H-pyrrolo[3,4-c]pyrazol-6-one CAS Name: 1-methyl-3-(4-methylphenyl)-5-(phenylmethyl)-4-(4-propoxyphenyl)-4H-pyrrolo[3,4-c]pyrazol-6-one IUPAC Name: 5-benzyl-1-methyl-3-(4-methylphenyl)-4-(4-propoxyphenyl)-4H-pyrrolo[3,4-c]pyrazol-6-one Traditional Name: 5-benzyl-1-methyl-4-(4-propoxyphenyl)-3-(p-tolyl)-4H-pyrrolo[3,4-c]pyrazol-6-one Formula: C29H29N3O2 MolecularWeight: 451.55946

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2C3=C(C(=O)N2CC4=CC=CC=C4)N(N=C3C5=CC=C(C=C5)C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2C3=C(C(=O)N2CC4=CC=CC=C4)N(N=C3C5=CC=C(C=C5)C)C

InChI

InChI=1S/C29H29N3O2/c1-4-18-34-24-16-14-23(15-17-24)27-25-26(22-12-10-20(2)11-13-22)30-31(3)28(25)29(33)32(27)19-21-8-6-5-7-9-21/h5-17,27H,4,18-19H2,1-3H3