(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl 1-cyanocyclopentane-1-carboxylate

Systemtic Name: (4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl 1-cyanocyclopentane-1-carboxylate Openeye Name: (4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl 1-cyanocyclopentanecarboxylate CAS Name: 1-cyano-1-cyclopentanecarboxylic acid (4-amino-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)methyl ester IUPAC Name: (4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methyl 1-cyanocyclopentane-1-carboxylate Traditional Name: 1-cyanocyclopentanecarboxylic acid (4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl ester Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)COC(=O)C3(CCCC3)C#N)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)COC(=O)C3(CCCC3)C#N)C

InChI

InChI=1S/C16H18N4O2S/c1-9-10(2)23-14-12(9)13(18)19-11(20-14)7-22-15(21)16(8-17)5-3-4-6-16/h3-7H2,1-2H3,(H2,18,19,20)