3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]propanamide

Systemtic Name: 3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]propanamide Openeye Name: 3-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]propanamide CAS Name: 3-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-N-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]propanamide IUPAC Name: 3-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]propanamide Traditional Name: 3-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]propionamide Formula: C20H20N6O2S MolecularWeight: 408.4768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)NCC3=CN=C(C=C3)N4C=CC=N4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)NCC3=CN=C(C=C3)N4C=CC=N4)C

InChI

InChI=1S/C20H20N6O2S/c1-13-14(2)29-19-18(13)20(28)25(12-23-19)9-6-17(27)22-11-15-4-5-16(21-10-15)26-8-3-7-24-26/h3-5,7-8,10,12H,6,9,11H2,1-2H3,(H,22,27)