2-[(2,5-dimethylphenyl)sulfanylmethyl]-5-methyl-6-morpholin-4-ylcarbonyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(2,5-dimethylphenyl)sulfanylmethyl]-5-methyl-6-morpholin-4-ylcarbonyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(2,5-dimethylphenyl)sulfanylmethyl]-5-methyl-6-(morpholine-4-carbonyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(2,5-dimethylphenyl)thio]methyl]-5-methyl-6-[4-morpholinyl(oxo)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(2,5-dimethylphenyl)sulfanylmethyl]-5-methyl-6-(morpholine-4-carbonyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(2,5-dimethylphenyl)thio]methyl]-5-methyl-6-(morpholine-4-carbonyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC2=NC3=C(C(=C(S3)C(=O)N4CCOCC4)C)C(=O)N2

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC2=NC3=C(C(=C(S3)C(=O)N4CCOCC4)C)C(=O)N2

InChI

InChI=1S/C21H23N3O3S2/c1-12-4-5-13(2)15(10-12)28-11-16-22-19(25)17-14(3)18(29-20(17)23-16)21(26)24-6-8-27-9-7-24/h4-5,10H,6-9,11H2,1-3H3,(H,22,23,25)