3-(4-methoxyphenyl)-2-methylsulfanyl-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(4-methoxyphenyl)-2-methylsulfanyl-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-(4-methoxyphenyl)-2-methylsulfanyl-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-(4-methoxyphenyl)-2-(methylthio)-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-(4-methoxyphenyl)-2-methylsulfanyl-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-methoxyphenyl)-2-(methylthio)benzothiopheno[2,3-d]pyrimidin-4-one Formula: C18H14N2O2S2 MolecularWeight: 354.44596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SC)SC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SC)SC4=CC=CC=C43

InChI

InChI=1S/C18H14N2O2S2/c1-22-12-9-7-11(8-10-12)20-17(21)15-13-5-3-4-6-14(13)24-16(15)19-18(20)23-2/h3-10H,1-2H3