5-(3,4-dimethylphenyl)-3-(oxan-2-ylmethyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3,4-dimethylphenyl)-3-(oxan-2-ylmethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(3,4-dimethylphenyl)-3-(tetrahydropyran-2-ylmethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3,4-dimethylphenyl)-3-(2-oxanylmethyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(3,4-dimethylphenyl)-3-(oxan-2-ylmethyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(3,4-dimethylphenyl)-3-(tetrahydropyran-2-ylmethyl)thieno[2,3-d]pyrimidin-4-one Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4CCCCO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC4CCCCO4)C

InChI

InChI=1S/C20H22N2O2S/c1-13-6-7-15(9-14(13)2)17-11-25-19-18(17)20(23)22(12-21-19)10-16-5-3-4-8-24-16/h6-7,9,11-12,16H,3-5,8,10H2,1-2H3