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

Systemtic Name: 3-cyclohexyl-2-[(2-methylphenyl)methylsulfanyl]-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 3-cyclohexyl-2-(o-tolylmethylsulfanyl)benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 3-cyclohexyl-2-[(2-methylphenyl)methylthio]-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-cyclohexyl-2-[(2-methylphenyl)methylsulfanyl]-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 3-cyclohexyl-2-[(2-methylbenzyl)thio]benzothiopheno[3,2-d]pyrimidin-4-one Formula: C24H24N2OS2 MolecularWeight: 420.59016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2C4CCCCC4)SC5=CC=CC=C53

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2C4CCCCC4)SC5=CC=CC=C53

InChI

InChI=1S/C24H24N2OS2/c1-16-9-5-6-10-17(16)15-28-24-25-21-19-13-7-8-14-20(19)29-22(21)23(27)26(24)18-11-3-2-4-12-18/h5-10,13-14,18H,2-4,11-12,15H2,1H3