2-[5-ethyl-6-methyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-[5-ethyl-6-methyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[5-ethyl-6-methyl-4-oxo-3-(tetrahydrofuran-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: 2-[[5-ethyl-6-methyl-4-oxo-3-(2-oxolanylmethyl)-2-thieno[2,3-d]pyrimidinyl]thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[5-ethyl-6-methyl-4-oxo-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[[5-ethyl-4-keto-6-methyl-3-(tetrahydrofurfuryl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-(2-nitrophenyl)acetamide Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=CC=CC=C3[N+](=O)[O-])CC4CCCO4)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=CC=CC=C3[N+](=O)[O-])CC4CCCO4)C

InChI

InChI=1S/C22H24N4O5S2/c1-3-15-13(2)33-20-19(15)21(28)25(11-14-7-6-10-31-14)22(24-20)32-12-18(27)23-16-8-4-5-9-17(16)26(29)30/h4-5,8-9,14H,3,6-7,10-12H2,1-2H3,(H,23,27)