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

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C22H18F3N5O2S MolecularWeight: 473.47083

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=C(N(N=C4)C5=CC=CC=C5)C(F)(F)F

InChI

InChI=1S/C22H18F3N5O2S/c23-22(24,25)19-16(13-26-30(19)15-4-2-1-3-5-15)20(31)27-14-6-7-17-18(12-14)33-21(28-17)29-8-10-32-11-9-29/h1-7,12-13H,8-11H2,(H,27,31)