N-(2-morpholin-4-ium-4-ylethyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-5,7-diphenyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-5,7-diphenylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-5,7-diphenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C25H26N5O2+ MolecularWeight: 428.50624

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=C3N=C(C=C(N3N=C2)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=C3N=C(C=C(N3N=C2)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H25N5O2/c31-25(26-11-12-29-13-15-32-16-14-29)21-18-27-30-23(20-9-5-2-6-10-20)17-22(28-24(21)30)19-7-3-1-4-8-19/h1-10,17-18H,11-16H2,(H,26,31)/p+1