3-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl]-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl]-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl]-6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl]-6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl]-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C)C4=CC=CC=C4

InChI

InChI=1S/C21H18N2O2S2/c1-12-9-16(13(2)26-12)17(24)10-23-11-22-20-19(21(23)25)18(14(3)27-20)15-7-5-4-6-8-15/h4-9,11H,10H2,1-3H3