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

Systemtic Name: 6-phenethyl-1-prop-2-enyl-4-(2,4,5-trimethylphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Openeye Name: 1-allyl-6-phenethyl-4-(2,4,5-trimethylphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione CAS Name: 6-phenethyl-1-prop-2-enyl-4-(2,4,5-trimethylphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione IUPAC Name: 6-phenethyl-1-prop-2-enyl-4-(2,4,5-trimethylphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Traditional Name: 1-allyl-6-phenethyl-4-(2,4,5-trimethylphenyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-quinone Formula: C26H29N3O2 MolecularWeight: 415.52736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2C3=C(CN(C3=O)CCC4=CC=CC=C4)N(C(=O)N2)CC=C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2C3=C(CN(C3=O)CCC4=CC=CC=C4)N(C(=O)N2)CC=C)C)C

InChI

InChI=1S/C26H29N3O2/c1-5-12-29-22-16-28(13-11-20-9-7-6-8-10-20)25(30)23(22)24(27-26(29)31)21-15-18(3)17(2)14-19(21)4/h5-10,14-15,24H,1,11-13,16H2,2-4H3,(H,27,31)