3-pentyl-2-(3,4,5-trimethoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 3-pentyl-2-(3,4,5-trimethoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-pentyl-2-(3,4,5-trimethoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-pentyl-2-(3,4,5-trimethoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-pentyl-2-(3,4,5-trimethoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-amyl-2-(3,4,5-trimethoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C25H26N2O5S MolecularWeight: 466.54934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3S2)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCCCCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3S2)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C25H26N2O5S/c1-5-6-9-12-27-23(15-13-17(30-2)22(32-4)18(14-15)31-3)26-24-20(25(27)29)21(28)16-10-7-8-11-19(16)33-24/h7-8,10-11,13-14H,5-6,9,12H2,1-4H3