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

Systemtic Name: 3-(4-methylphenyl)-2-methylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 2-methylsulfanyl-3-(p-tolyl)benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 3-(4-methylphenyl)-2-(methylthio)-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-(4-methylphenyl)-2-methylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 2-(methylthio)-3-(p-tolyl)benzothiopheno[3,2-d]pyrimidin-4-one Formula: C18H14N2OS2 MolecularWeight: 338.44656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4S3)N=C2SC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4S3)N=C2SC

InChI

InChI=1S/C18H14N2OS2/c1-11-7-9-12(10-8-11)20-17(21)16-15(19-18(20)22-2)13-5-3-4-6-14(13)23-16/h3-10H,1-2H3