3-[4,4-bis(4-fluorophenyl)butylsulfanyl]-5-methyl-1,2,4-triazol-4-amine

Systemtic Name: 3-[4,4-bis(4-fluorophenyl)butylsulfanyl]-5-methyl-1,2,4-triazol-4-amine Openeye Name: 3-[4,4-bis(4-fluorophenyl)butylsulfanyl]-5-methyl-1,2,4-triazol-4-amine CAS Name: 3-[4,4-bis(4-fluorophenyl)butylthio]-5-methyl-1,2,4-triazol-4-amine IUPAC Name: 3-[4,4-bis(4-fluorophenyl)butylsulfanyl]-5-methyl-1,2,4-triazol-4-amine Traditional Name: [3-[4,4-bis(4-fluorophenyl)butylthio]-5-methyl-1,2,4-triazol-4-yl]amine Formula: C19H20F2N4S MolecularWeight: 374.450706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN=C(N1N)SCCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H20F2N4S/c1-13-23-24-19(25(13)22)26-12-2-3-18(14-4-8-16(20)9-5-14)15-6-10-17(21)11-7-15/h4-11,18H,2-3,12,22H2,1H3