N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-cyclopropyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-cyclopropyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-cyclopropyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H22N4OS2 MolecularWeight: 422.56628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)C)C3CC3)C(=O)NCCSCC4=CC=CC=C4C#N

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)C)C3CC3)C(=O)NCCSCC4=CC=CC=C4C#N

InChI

InChI=1S/C22H22N4OS2/c1-13-18-14(2)25-20(15-7-8-15)26-22(18)29-19(13)21(27)24-9-10-28-12-17-6-4-3-5-16(17)11-23/h3-6,15H,7-10,12H2,1-2H3,(H,24,27)