N5-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-[4-(3-fluoro-4-methoxyphenyl)-2-thiazolyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C21H18FN5O3S MolecularWeight: 439.462723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(C3)C(=O)N)C4=CC=CC=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(C3)C(=O)N)C4=CC=CC=C4)F

InChI

InChI=1S/C21H18FN5O3S/c1-30-18-8-7-12(9-14(18)22)16-11-31-21(24-16)25-20(29)15-10-17(19(23)28)27(26-15)13-5-3-2-4-6-13/h2-9,11,17H,10H2,1H3,(H2,23,28)(H,24,25,29)