2-ethyl-4,5-dimethyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-ethyl-4,5-dimethyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-ethyl-4,5-dimethyl-N-[4-(3-pyridylmethylsulfanyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-ethyl-4,5-dimethyl-N-[4-(3-pyridinylmethylthio)phenyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-ethyl-4,5-dimethyl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-ethyl-4,5-dimethyl-N-[4-(3-pyridylmethylthio)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C23H22N4OS2 MolecularWeight: 434.57698

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4)C)C

Isomeric SMILES

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4)C)C

InChI

InChI=1S/C23H22N4OS2/c1-4-19-25-15(3)20-14(2)21(30-23(20)27-19)22(28)26-17-7-9-18(10-8-17)29-13-16-6-5-11-24-12-16/h5-12H,4,13H2,1-3H3,(H,26,28)