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

Systemtic Name: 4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-2-(trifluoromethyl)quinazoline Openeye Name: 4-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-2-(trifluoromethyl)quinazoline CAS Name: 4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-2-(trifluoromethyl)quinazoline IUPAC Name: 4-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-2-(trifluoromethyl)quinazoline Traditional Name: 4-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-2-(trifluoromethyl)quinazoline Formula: C18H12F3N5S2 MolecularWeight: 419.44659

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SC3=NC(=NC4=CC=CC=C43)C(F)(F)F)C5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SC3=NC(=NC4=CC=CC=C43)C(F)(F)F)C5=CC=CS5

InChI

InChI=1S/C18H12F3N5S2/c19-18(20,21)16-22-12-5-2-1-4-11(12)15(23-16)28-17-25-24-14(13-6-3-9-27-13)26(17)10-7-8-10/h1-6,9-10H,7-8H2