5-(methoxymethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-1-(4-thiophen-2-ylpyrimidin-2-yl)pyrazole-4-carboxamide

Systemtic Name: 5-(methoxymethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-1-(4-thiophen-2-ylpyrimidin-2-yl)pyrazole-4-carboxamide Openeye Name: 5-(methoxymethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-1-[4-(2-thienyl)pyrimidin-2-yl]pyrazole-4-carboxamide CAS Name: 5-(methoxymethyl)-N-[[1-(4-morpholin-4-iumyl)cyclopentyl]methyl]-1-(4-thiophen-2-yl-2-pyrimidinyl)-4-pyrazolecarboxamide IUPAC Name: 5-(methoxymethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-1-(4-thiophen-2-ylpyrimidin-2-yl)pyrazole-4-carboxamide Traditional Name: 5-(methoxymethyl)-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-1-[4-(2-thienyl)pyrimidin-2-yl]pyrazole-4-carboxamide Formula: C24H31N6O3S+ MolecularWeight: 483.60634

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C=NN1C2=NC=CC(=N2)C3=CC=CS3)C(=O)NCC4(CCCC4)[NH+]5CCOCC5

Isomeric SMILES

COCC1=C(C=NN1C2=NC=CC(=N2)C3=CC=CS3)C(=O)NCC4(CCCC4)[NH+]5CCOCC5

InChI

InChI=1S/C24H30N6O3S/c1-32-16-20-18(15-27-30(20)23-25-9-6-19(28-23)21-5-4-14-34-21)22(31)26-17-24(7-2-3-8-24)29-10-12-33-13-11-29/h4-6,9,14-15H,2-3,7-8,10-13,16-17H2,1H3,(H,26,31)/p+1