5-cyclopropyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-(4-thiophen-2-ylpyrimidin-2-yl)pyrazole-4-carboxamide

Systemtic Name: 5-cyclopropyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-(4-thiophen-2-ylpyrimidin-2-yl)pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-[4-(2-thienyl)pyrimidin-2-yl]pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-1-(4-thiophen-2-yl-2-pyrimidinyl)-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-1-(4-thiophen-2-ylpyrimidin-2-yl)pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1-[4-(2-thienyl)pyrimidin-2-yl]pyrazole-4-carboxamide Formula: C23H29N6O2S+ MolecularWeight: 453.58036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=C(N(N=C1)C2=NC=CC(=N2)C3=CC=CS3)C4CC4)[NH+]5CCOCC5

Isomeric SMILES

CC(C)(CNC(=O)C1=C(N(N=C1)C2=NC=CC(=N2)C3=CC=CS3)C4CC4)[NH+]5CCOCC5

InChI

InChI=1S/C23H28N6O2S/c1-23(2,28-9-11-31-12-10-28)15-25-21(30)17-14-26-29(20(17)16-5-6-16)22-24-8-7-18(27-22)19-4-3-13-32-19/h3-4,7-8,13-14,16H,5-6,9-12,15H2,1-2H3,(H,25,30)/p+1