N-(1,3-benzothiazol-2-yl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-(6-methoxy-3-pyridazinyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C17H11F3N6O2S MolecularWeight: 420.36845

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NC3=NC4=CC=CC=C4S3)C(F)(F)F

Isomeric SMILES

COC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NC3=NC4=CC=CC=C4S3)C(F)(F)F

InChI

InChI=1S/C17H11F3N6O2S/c1-28-13-7-6-12(24-25-13)26-14(17(18,19)20)9(8-21-26)15(27)23-16-22-10-4-2-3-5-11(10)29-16/h2-8H,1H3,(H,22,23,27)