2,5-dimethyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2,5-dimethyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2,5-dimethyl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2,5-dimethyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2,5-dimethyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2,5-dimethyl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C12H14N2OS MolecularWeight: 234.31736

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC2=C1C3=C(S2)N=C(NC3=O)C

Isomeric SMILES

CC1CCCC2=C1C3=C(S2)N=C(NC3=O)C

InChI

InChI=1S/C12H14N2OS/c1-6-4-3-5-8-9(6)10-11(15)13-7(2)14-12(10)16-8/h6H,3-5H2,1-2H3,(H,13,14,15)