3-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(4-ethylphenyl)-2-oxidanylidene-ethyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(4-ethylphenyl)-2-oxo-ethyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(4-ethylphenyl)-2-oxoethyl]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(4-ethylphenyl)-2-oxoethyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(4-ethylphenyl)-2-keto-ethyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C)C

InChI

InChI=1S/C18H18N2O2S/c1-4-13-5-7-14(8-6-13)15(21)9-20-10-19-17-16(18(20)22)11(2)12(3)23-17/h5-8,10H,4,9H2,1-3H3