5,6-dimethyl-2-[(3-methylphenyl)methylsulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(3-methylphenyl)methylsulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(m-tolylmethylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[(3-methylphenyl)methylthio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[(3-methylphenyl)methylsulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[[(3-methylbenzyl)thio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H18N2OS2 MolecularWeight: 330.46762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCC2=NC3=C(C(=C(S3)C)C)C(=O)N2

Isomeric SMILES

CC1=CC(=CC=C1)CSCC2=NC3=C(C(=C(S3)C)C)C(=O)N2

InChI

InChI=1S/C17H18N2OS2/c1-10-5-4-6-13(7-10)8-21-9-14-18-16(20)15-11(2)12(3)22-17(15)19-14/h4-7H,8-9H2,1-3H3,(H,18,19,20)