3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Openeye Name: 3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-(4-tert-butylphenoxy)ethylthio]-5-thiophen-2-yl-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(4-tert-butylphenoxy)ethylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Traditional Name: [3-[2-(4-tert-butylphenoxy)ethylthio]-5-(2-thienyl)-1,2,4-triazol-4-yl]amine Formula: C18H22N4OS2 MolecularWeight: 374.52348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCSC2=NN=C(N2N)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCSC2=NN=C(N2N)C3=CC=CS3

InChI

InChI=1S/C18H22N4OS2/c1-18(2,3)13-6-8-14(9-7-13)23-10-12-25-17-21-20-16(22(17)19)15-5-4-11-24-15/h4-9,11H,10,12,19H2,1-3H3