6-(3-methylbutan-2-yl)-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione

Systemtic Name: 6-(3-methylbutan-2-yl)-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Openeye Name: 1-allyl-6-(1,2-dimethylpropyl)-4-(3-phenoxyphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione CAS Name: 6-(3-methylbutan-2-yl)-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione IUPAC Name: 6-(3-methylbutan-2-yl)-4-(3-phenoxyphenyl)-1-prop-2-enyl-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Traditional Name: 1-allyl-6-(1,2-dimethylpropyl)-4-(3-phenoxyphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-quinone Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)N1CC2=C(C1=O)C(NC(=O)N2CC=C)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)C(C)N1CC2=C(C1=O)C(NC(=O)N2CC=C)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3/c1-5-14-28-22-16-29(18(4)17(2)3)25(30)23(22)24(27-26(28)31)19-10-9-13-21(15-19)32-20-11-7-6-8-12-20/h5-13,15,17-18,24H,1,14,16H2,2-4H3,(H,27,31)