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

Systemtic Name: 3-[(4-methylphenyl)methyl]-2-methylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 2-methylsulfanyl-3-(p-tolylmethyl)benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 3-[(4-methylphenyl)methyl]-2-(methylthio)-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-[(4-methylphenyl)methyl]-2-methylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 3-(4-methylbenzyl)-2-(methylthio)benzothiopheno[3,2-d]pyrimidin-4-one Formula: C19H16N2OS2 MolecularWeight: 352.47314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=C(C4=CC=CC=C4S3)N=C2SC

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=C(C4=CC=CC=C4S3)N=C2SC

InChI

InChI=1S/C19H16N2OS2/c1-12-7-9-13(10-8-12)11-21-18(22)17-16(20-19(21)23-2)14-5-3-4-6-15(14)24-17/h3-10H,11H2,1-2H3