3-[[4-(3-methylbutoxy)phenyl]methylsulfanyl]-5-propyl-1,2,4-triazol-4-amine

Systemtic Name: 3-[[4-(3-methylbutoxy)phenyl]methylsulfanyl]-5-propyl-1,2,4-triazol-4-amine Openeye Name: 3-[(4-isopentyloxyphenyl)methylsulfanyl]-5-propyl-1,2,4-triazol-4-amine CAS Name: 3-[[4-(3-methylbutoxy)phenyl]methylthio]-5-propyl-1,2,4-triazol-4-amine IUPAC Name: 3-[[4-(3-methylbutoxy)phenyl]methylsulfanyl]-5-propyl-1,2,4-triazol-4-amine Traditional Name: [3-[(4-isoamoxybenzyl)thio]-5-propyl-1,2,4-triazol-4-yl]amine Formula: C17H26N4OS MolecularWeight: 334.47954

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1N)SCC2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CCCC1=NN=C(N1N)SCC2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C17H26N4OS/c1-4-5-16-19-20-17(21(16)18)23-12-14-6-8-15(9-7-14)22-11-10-13(2)3/h6-9,13H,4-5,10-12,18H2,1-3H3