[4-fluoranyl-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]methanamine

Systemtic Name: [4-fluoranyl-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]methanamine Openeye Name: [4-fluoro-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]methanamine CAS Name: [4-fluoro-3-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]methanamine IUPAC Name: [4-fluoro-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]methanamine Traditional Name: [4-fluoro-3-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzyl]amine Formula: C11H13FN4S MolecularWeight: 252.311123

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC2=C(C=CC(=C2)CN)F

Isomeric SMILES

CN1C=NN=C1SCC2=C(C=CC(=C2)CN)F

InChI

InChI=1S/C11H13FN4S/c1-16-7-14-15-11(16)17-6-9-4-8(5-13)2-3-10(9)12/h2-4,7H,5-6,13H2,1H3