3-[2-(3,4-dimethoxyphenyl)ethyl]-2-thiophen-2-yl-chromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-thiophen-2-yl-chromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-thienyl)chromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-thiophen-2-yl[1]benzopyrano[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-thiophen-2-ylchromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-homoveratryl-2-(2-thienyl)chromeno[2,3-d]pyrimidine-4,5-quinone Formula: C25H20N2O5S MolecularWeight: 460.5017

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4O3)C5=CC=CS5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4O3)C5=CC=CS5)OC

InChI

InChI=1S/C25H20N2O5S/c1-30-18-10-9-15(14-19(18)31-2)11-12-27-23(20-8-5-13-33-20)26-24-21(25(27)29)22(28)16-6-3-4-7-17(16)32-24/h3-10,13-14H,11-12H2,1-2H3