4-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-(trifluoromethyl)quinazoline

Systemtic Name: 4-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-(trifluoromethyl)quinazoline Openeye Name: 4-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-(trifluoromethyl)quinazoline CAS Name: 4-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]-2-(trifluoromethyl)quinazoline IUPAC Name: 4-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-(trifluoromethyl)quinazoline Traditional Name: 4-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]-2-(trifluoromethyl)quinazoline Formula: C14H12F3N5S MolecularWeight: 339.33879

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CCCC1=NC(=NN1)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C14H12F3N5S/c1-2-5-10-19-13(22-21-10)23-11-8-6-3-4-7-9(8)18-12(20-11)14(15,16)17/h3-4,6-7H,2,5H2,1H3,(H,19,21,22)