N-[(3,4-diethoxyphenyl)methyl]-7-thiophen-2-yl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-7-thiophen-2-yl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-7-(2-thienyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-7-thiophen-2-yl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-(3,4-diethoxybenzyl)-7-(2-thienyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C22H22N4O3S MolecularWeight: 422.50008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=C3N=CC=C(N3N=C2)C4=CC=CS4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=C3N=CC=C(N3N=C2)C4=CC=CS4)OCC

InChI

InChI=1S/C22H22N4O3S/c1-3-28-18-8-7-15(12-19(18)29-4-2)13-24-22(27)16-14-25-26-17(9-10-23-21(16)26)20-6-5-11-30-20/h5-12,14H,3-4,13H2,1-2H3,(H,24,27)