3-(4-ethylphenyl)-5,6-dimethyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(4-ethylphenyl)-5,6-dimethyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(4-ethylphenyl)-5,6-dimethyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(4-ethylphenyl)-5,6-dimethyl-2-(phenacylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(4-ethylphenyl)-5,6-dimethyl-2-phenacylsulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-ethylphenyl)-5,6-dimethyl-2-(phenacylthio)thieno[2,3-d]pyrimidin-4-one Formula: C24H22N2O2S2 MolecularWeight: 434.57368

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=CC=C4)SC(=C3C)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=CC=C4)SC(=C3C)C

InChI

InChI=1S/C24H22N2O2S2/c1-4-17-10-12-19(13-11-17)26-23(28)21-15(2)16(3)30-22(21)25-24(26)29-14-20(27)18-8-6-5-7-9-18/h5-13H,4,14H2,1-3H3