N-[3,5-bis(trifluoromethyl)phenyl]-2-chloranyl-4-thiophen-2-yl-pyrimidine-5-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-chloranyl-4-thiophen-2-yl-pyrimidine-5-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-chloro-4-(2-thienyl)pyrimidine-5-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-chloro-4-thiophen-2-yl-5-pyrimidinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-chloro-4-thiophen-2-ylpyrimidine-5-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-chloro-4-(2-thienyl)pyrimidine-5-carboxamide Formula: C17H8ClF6N3OS MolecularWeight: 451.773339

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NC=C2C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)Cl

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NC=C2C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)Cl

InChI

InChI=1S/C17H8ClF6N3OS/c18-15-25-7-11(13(27-15)12-2-1-3-29-12)14(28)26-10-5-8(16(19,20)21)4-9(6-10)17(22,23)24/h1-7H,(H,26,28)