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

Systemtic Name: 1-methyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-methyl-N-(2-morpholino-1,3-benzothiazol-6-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-methyl-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-methyl-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-methyl-N-(2-morpholino-1,3-benzothiazol-6-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C17H16F3N5O2S MolecularWeight: 411.40145

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)C(F)(F)F

Isomeric SMILES

CN1C(=C(C=N1)C(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4)C(F)(F)F

InChI

InChI=1S/C17H16F3N5O2S/c1-24-14(17(18,19)20)11(9-21-24)15(26)22-10-2-3-12-13(8-10)28-16(23-12)25-4-6-27-7-5-25/h2-3,8-9H,4-7H2,1H3,(H,22,26)