2-[3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-2,4-bis(oxidanylidene)thieno[3,2-d]pyrimidin-1-yl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-2,4-bis(oxidanylidene)thieno[3,2-d]pyrimidin-1-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl]-2,4-dioxo-thieno[3,2-d]pyrimidin-1-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]-2,4-dioxo-1-thieno[3,2-d]pyrimidinyl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]-2,4-dioxothieno[3,2-d]pyrimidin-1-yl]-N-(4-fluorophenyl)acetamide Traditional Name: N-(4-fluorophenyl)-2-[3-[2-(homoveratrylamino)-2-keto-ethyl]-2,4-diketo-thieno[3,2-d]pyrimidin-1-yl]acetamide Formula: C26H25FN4O6S MolecularWeight: 540.563303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CN2C(=O)C3=C(C=CS3)N(C2=O)CC(=O)NC4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CN2C(=O)C3=C(C=CS3)N(C2=O)CC(=O)NC4=CC=C(C=C4)F)OC

InChI

InChI=1S/C26H25FN4O6S/c1-36-20-8-3-16(13-21(20)37-2)9-11-28-22(32)14-31-25(34)24-19(10-12-38-24)30(26(31)35)15-23(33)29-18-6-4-17(27)5-7-18/h3-8,10,12-13H,9,11,14-15H2,1-2H3,(H,28,32)(H,29,33)