3-[1-(4-fluorophenyl)ethylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[1-(4-fluorophenyl)ethylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine Openeye Name: 3-[1-(4-fluorophenyl)ethylsulfanyl]-5-(1-naphthylmethyl)-1,2,4-triazol-4-amine CAS Name: 3-[1-(4-fluorophenyl)ethylthio]-5-(1-naphthalenylmethyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[1-(4-fluorophenyl)ethylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine Traditional Name: [3-[1-(4-fluorophenyl)ethylthio]-5-(1-naphthylmethyl)-1,2,4-triazol-4-yl]amine Formula: C21H19FN4S MolecularWeight: 378.465763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)SC2=NN=C(N2N)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C1=CC=C(C=C1)F)SC2=NN=C(N2N)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H19FN4S/c1-14(15-9-11-18(22)12-10-15)27-21-25-24-20(26(21)23)13-17-7-4-6-16-5-2-3-8-19(16)17/h2-12,14H,13,23H2,1H3