5-ethyl-3-(2-methoxyethyl)-6-methyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-ethyl-3-(2-methoxyethyl)-6-methyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-ethyl-3-(2-methoxyethyl)-6-methyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-ethyl-3-(2-methoxyethyl)-6-methyl-2-(phenacylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-ethyl-3-(2-methoxyethyl)-6-methyl-2-phenacylsulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-ethyl-3-(2-methoxyethyl)-6-methyl-2-(phenacylthio)thieno[2,3-d]pyrimidin-4-one Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)CCOC)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)CCOC)C

InChI

InChI=1S/C20H22N2O3S2/c1-4-15-13(2)27-18-17(15)19(24)22(10-11-25-3)20(21-18)26-12-16(23)14-8-6-5-7-9-14/h5-9H,4,10-12H2,1-3H3