2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-4-quinazolinamine IUPAC Name: 2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]quinazolin-4-yl]amine Formula: C18H15FN6S MolecularWeight: 366.415303

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N)C4=CC=C(C=C4)F

Isomeric SMILES

CN1C(=NN=C1SCC2=NC3=CC=CC=C3C(=N2)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H15FN6S/c1-25-17(11-6-8-12(19)9-7-11)23-24-18(25)26-10-15-21-14-5-3-2-4-13(14)16(20)22-15/h2-9H,10H2,1H3,(H2,20,21,22)