N-(3-methylpent-1-yn-3-yl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: N-(3-methylpent-1-yn-3-yl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: N-(1-ethyl-1-methyl-prop-2-ynyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: N-(3-methylpent-1-yn-3-yl)-5,7-diphenyl-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-(3-methylpent-1-yn-3-yl)-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: N-(1-ethyl-1-methyl-prop-2-ynyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#C)NC(=O)C1=NN2C(=CC(=NC2=C1)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(C)(C#C)NC(=O)C1=NN2C(=CC(=NC2=C1)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O/c1-4-25(3,5-2)27-24(30)21-17-23-26-20(18-12-8-6-9-13-18)16-22(29(23)28-21)19-14-10-7-11-15-19/h1,6-17H,5H2,2-3H3,(H,27,30)