3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]propanamide

Systemtic Name: 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Openeye Name: 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]propanamide CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)-N-[(1-phenyl-4-pyrazolyl)methyl]propanamide IUPAC Name: 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]propionamide Formula: C19H17N5O2S MolecularWeight: 379.43558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)CCN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CNC(=O)CCN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C19H17N5O2S/c25-17(6-8-23-13-21-18-16(19(23)26)7-9-27-18)20-10-14-11-22-24(12-14)15-4-2-1-3-5-15/h1-5,7,9,11-13H,6,8,10H2,(H,20,25)