1-[2,4-bis(fluoranyl)phenyl]-N-(3-morpholin-4-ylpropyl)-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-N-(3-morpholin-4-ylpropyl)-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: 1-(2,4-difluorophenyl)-N-(3-morpholinopropyl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: 1-(2,4-difluorophenyl)-N-[3-(4-morpholinyl)propyl]-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: 1-(2,4-difluorophenyl)-N-(3-morpholin-4-ylpropyl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 1-(2,4-difluorophenyl)-N-(3-morpholinopropyl)-5-(2-thienyl)pyrazole-3-carboxamide Formula: C21H22F2N4O2S MolecularWeight: 432.486786

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C2=NN(C(=C2)C3=CC=CS3)C4=C(C=C(C=C4)F)F

Isomeric SMILES

C1COCCN1CCCNC(=O)C2=NN(C(=C2)C3=CC=CS3)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C21H22F2N4O2S/c22-15-4-5-18(16(23)13-15)27-19(20-3-1-12-30-20)14-17(25-27)21(28)24-6-2-7-26-8-10-29-11-9-26/h1,3-5,12-14H,2,6-11H2,(H,24,28)