1-methyl-4-(3-phenylmethoxyphenyl)-6-(2-thiophen-2-ylethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione

Systemtic Name: 1-methyl-4-(3-phenylmethoxyphenyl)-6-(2-thiophen-2-ylethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Openeye Name: 4-(3-benzyloxyphenyl)-1-methyl-6-[2-(2-thienyl)ethyl]-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione CAS Name: 1-methyl-4-(3-phenylmethoxyphenyl)-6-(2-thiophen-2-ylethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione IUPAC Name: 1-methyl-4-(3-phenylmethoxyphenyl)-6-(2-thiophen-2-ylethyl)-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-dione Traditional Name: 4-(3-benzoxyphenyl)-1-methyl-6-[2-(2-thienyl)ethyl]-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidine-2,5-quinone Formula: C26H25N3O3S MolecularWeight: 459.56

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(NC1=O)C3=CC(=CC=C3)OCC4=CC=CC=C4)C(=O)N(C2)CCC5=CC=CS5

Isomeric SMILES

CN1C2=C(C(NC1=O)C3=CC(=CC=C3)OCC4=CC=CC=C4)C(=O)N(C2)CCC5=CC=CS5

InChI

InChI=1S/C26H25N3O3S/c1-28-22-16-29(13-12-21-11-6-14-33-21)25(30)23(22)24(27-26(28)31)19-9-5-10-20(15-19)32-17-18-7-3-2-4-8-18/h2-11,14-15,24H,12-13,16-17H2,1H3,(H,27,31)