2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]-4-quinazolinamine IUPAC Name: 2-[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[[4-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]methyl]quinazolin-4-yl]amine Formula: C17H13FN6S MolecularWeight: 352.388723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=NN=CN3C4=CC=CC=C4F)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=NN=CN3C4=CC=CC=C4F)N

InChI

InChI=1S/C17H13FN6S/c18-12-6-2-4-8-14(12)24-10-20-23-17(24)25-9-15-21-13-7-3-1-5-11(13)16(19)22-15/h1-8,10H,9H2,(H2,19,21,22)