5-methyl-3-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 5-methyl-3-[2-(2-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-methyl-3-[2-(2-methyl-1-piperidyl)-2-oxo-ethyl]-4-oxo-N-(2-pyridylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-methyl-3-[2-(2-methyl-1-piperidinyl)-2-oxoethyl]-4-oxo-N-(2-pyridinylmethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 5-methyl-3-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]-4-oxo-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-keto-3-[2-keto-2-(2-methylpiperidino)ethyl]-5-methyl-N-(2-pyridylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)NCC4=CC=CC=N4)C

Isomeric SMILES

CC1CCCCN1C(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)NCC4=CC=CC=N4)C

InChI

InChI=1S/C22H25N5O3S/c1-14-7-4-6-10-27(14)17(28)12-26-13-25-21-18(22(26)30)15(2)19(31-21)20(29)24-11-16-8-3-5-9-23-16/h3,5,8-9,13-14H,4,6-7,10-12H2,1-2H3,(H,24,29)