N-(3-cyclopropyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-(3-cyclopropyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-(3-cyclopropyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-(3-cyclopropyl-5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-(3-cyclopropyl-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-(3-cyclopropyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-1-oxido-pyridin-1-ium-3-carboxamide Formula: C21H17N5O2 MolecularWeight: 371.39198

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C3N=C(C=C(N3N=C2)NC(=O)C4=C[N+](=CC=C4)[O-])C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=C3N=C(C=C(N3N=C2)NC(=O)C4=C[N+](=CC=C4)[O-])C5=CC=CC=C5

InChI

InChI=1S/C21H17N5O2/c27-21(16-7-4-10-25(28)13-16)24-19-11-18(15-5-2-1-3-6-15)23-20-17(14-8-9-14)12-22-26(19)20/h1-7,10-14H,8-9H2,(H,24,27)