5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)pyrimidin-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)pyrazole-4-carboxamide

Systemtic Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)pyrimidin-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)pyrimidin-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)-2-pyrimidinyl]-N-[3-(4-morpholin-4-iumyl)propyl]-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)pyrimidin-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)pyrimidin-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)pyrazole-4-carboxamide Formula: C26H33N6O4+ MolecularWeight: 493.57802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCCC[NH+]4CCOCC4)C5CC5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCCC[NH+]4CCOCC4)C5CC5

InChI

InChI=1S/C26H32N6O4/c1-34-19-6-7-23(35-2)20(16-19)22-8-10-28-26(30-22)32-24(18-4-5-18)21(17-29-32)25(33)27-9-3-11-31-12-14-36-15-13-31/h6-8,10,16-18H,3-5,9,11-15H2,1-2H3,(H,27,33)/p+1