3-methyl-6-[(1-methylbenzimidazol-2-yl)-oxidanyl-methyl]-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 3-methyl-6-[(1-methylbenzimidazol-2-yl)-oxidanyl-methyl]-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 6-[hydroxy-(1-methylbenzimidazol-2-yl)methyl]-1-isobutyl-3-methyl-thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 6-[hydroxy-(1-methyl-2-benzimidazolyl)methyl]-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 6-[hydroxy-(1-methylbenzimidazol-2-yl)methyl]-3-methyl-1-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 6-[hydroxy-(1-methylbenzimidazol-2-yl)methyl]-1-isobutyl-3-methyl-thieno[2,3-d]pyrimidine-2,4-quinone Formula: C20H22N4O3S MolecularWeight: 398.47868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(S2)C(C3=NC4=CC=CC=C4N3C)O)C(=O)N(C1=O)C

Isomeric SMILES

CC(C)CN1C2=C(C=C(S2)C(C3=NC4=CC=CC=C4N3C)O)C(=O)N(C1=O)C

InChI

InChI=1S/C20H22N4O3S/c1-11(2)10-24-19-12(18(26)23(4)20(24)27)9-15(28-19)16(25)17-21-13-7-5-6-8-14(13)22(17)3/h5-9,11,16,25H,10H2,1-4H3