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

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethylamino)-1,2-thiazole-3-carboxamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-pyridylmethylamino)isothiazole-3-carboxamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethylamino)-3-isothiazolecarboxamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(pyridin-4-ylmethylamino)-1,2-thiazole-3-carboxamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-pyridylmethylamino)isothiazole-3-carboxamide Formula: C17H12ClF3N4OS MolecularWeight: 412.81659

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C2=NSC=C2NCC3=CC=NC=C3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)C2=NSC=C2NCC3=CC=NC=C3)C(F)(F)F)Cl

InChI

InChI=1S/C17H12ClF3N4OS/c18-13-2-1-11(7-12(13)17(19,20)21)24-16(26)15-14(9-27-25-15)23-8-10-3-5-22-6-4-10/h1-7,9,23H,8H2,(H,24,26)