N-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-(5,7-dimethyl-2-pyrazolo[1,5-a]pyrimidinyl)-5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C17H20N5OS+ MolecularWeight: 342.4386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC(=NN12)NC(=O)C3=CC=C(S3)C4CCC[NH2+]4)C

Isomeric SMILES

CC1=CC(=NC2=CC(=NN12)NC(=O)C3=CC=C(S3)[C@H]4CCC[NH2+]4)C

InChI

InChI=1S/C17H19N5OS/c1-10-8-11(2)22-16(19-10)9-15(21-22)20-17(23)14-6-5-13(24-14)12-4-3-7-18-12/h5-6,8-9,12,18H,3-4,7H2,1-2H3,(H,20,21,23)/p+1/t12-/m1/s1