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

Systemtic Name: 5,6-dimethyl-3-(4-methylpyridin-2-yl)-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-3-(4-methyl-2-pyridyl)-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-(4-methyl-2-pyridinyl)-2-(phenacylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-3-(4-methylpyridin-2-yl)-2-phenacylsulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-3-(4-methyl-2-pyridyl)-2-(phenacylthio)thieno[2,3-d]pyrimidin-4-one Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=CC=C4)SC(=C3C)C

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=CC=C4)SC(=C3C)C

InChI

InChI=1S/C22H19N3O2S2/c1-13-9-10-23-18(11-13)25-21(27)19-14(2)15(3)29-20(19)24-22(25)28-12-17(26)16-7-5-4-6-8-16/h4-11H,12H2,1-3H3