4-(pyridin-3-ylmethylamino)-N-[4-(trifluoromethyl)phenyl]-1,2-thiazole-3-carboxamide

Systemtic Name: 4-(pyridin-3-ylmethylamino)-N-[4-(trifluoromethyl)phenyl]-1,2-thiazole-3-carboxamide Openeye Name: 4-(3-pyridylmethylamino)-N-[4-(trifluoromethyl)phenyl]isothiazole-3-carboxamide CAS Name: 4-(3-pyridinylmethylamino)-N-[4-(trifluoromethyl)phenyl]-3-isothiazolecarboxamide IUPAC Name: 4-(pyridin-3-ylmethylamino)-N-[4-(trifluoromethyl)phenyl]-1,2-thiazole-3-carboxamide Traditional Name: 4-(3-pyridylmethylamino)-N-[4-(trifluoromethyl)phenyl]isothiazole-3-carboxamide Formula: C17H13F3N4OS MolecularWeight: 378.37153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=CSN=C2C(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CN=C1)CNC2=CSN=C2C(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H13F3N4OS/c18-17(19,20)12-3-5-13(6-4-12)23-16(25)15-14(10-26-24-15)22-9-11-2-1-7-21-8-11/h1-8,10,22H,9H2,(H,23,25)