N-[3,5-bis(trifluoromethyl)phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(quinazolin-4-ylthio)acetamide Formula: C18H11F6N3OS MolecularWeight: 431.354859

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H11F6N3OS/c19-17(20,21)10-5-11(18(22,23)24)7-12(6-10)27-15(28)8-29-16-13-3-1-2-4-14(13)25-9-26-16/h1-7,9H,8H2,(H,27,28)