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

Systemtic Name: N-(4-ethylphenyl)-5-methyl-4-oxidanylidene-3-(pyridin-4-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-ethylphenyl)-5-methyl-4-oxo-3-(4-pyridylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-ethylphenyl)-5-methyl-4-oxo-3-(pyridin-4-ylmethyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-ethylphenyl)-5-methyl-4-oxo-3-(pyridin-4-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-ethylphenyl)-4-keto-5-methyl-3-(4-pyridylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)N=CN(C3=O)CC4=CC=NC=C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)N=CN(C3=O)CC4=CC=NC=C4)C

InChI

InChI=1S/C22H20N4O2S/c1-3-15-4-6-17(7-5-15)25-20(27)19-14(2)18-21(29-19)24-13-26(22(18)28)12-16-8-10-23-11-9-16/h4-11,13H,3,12H2,1-2H3,(H,25,27)