N-(1-cyclopropylpiperidin-1-ium-4-yl)-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(1-cyclopropyl-4-piperidin-1-iumyl)-1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C22H25N4OS+ MolecularWeight: 393.5251

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+]2CCC(CC2)NC(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1CC1[NH+]2CCC(CC2)NC(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C22H24N4OS/c27-22(23-16-10-12-25(13-11-16)17-8-9-17)19-15-26(18-5-2-1-3-6-18)24-21(19)20-7-4-14-28-20/h1-7,14-17H,8-13H2,(H,23,27)/p+1