2-[(3-methoxyphenyl)methylsulfanylmethyl]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanylmethyl]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3-methoxyphenyl)methylsulfanylmethyl]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(3-methoxyphenyl)methylthio]methyl]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanylmethyl]-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(m-anisylthio)methyl]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2O2S2 MolecularWeight: 408.5364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CSCC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CSCC4=CC(=CC=C4)OC

InChI

InChI=1S/C22H20N2O2S2/c1-14-6-8-16(9-7-14)18-12-28-22-20(18)21(25)23-19(24-22)13-27-11-15-4-3-5-17(10-15)26-2/h3-10,12H,11,13H2,1-2H3,(H,23,24,25)