2-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-3-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-3-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-3-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-[(2-methoxy-5-methylphenyl)methylthio]-3-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(2-methoxy-5-methylphenyl)methylsulfanyl]-3-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-[(2-methoxy-5-methyl-benzyl)thio]-3-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C20H22N2O2S2 MolecularWeight: 386.53088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C

InChI

InChI=1S/C20H22N2O2S2/c1-12-8-9-15(24-3)13(10-12)11-25-20-21-18-17(19(23)22(20)2)14-6-4-5-7-16(14)26-18/h8-10H,4-7,11H2,1-3H3