3-butyl-5-[(3-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-butyl-5-[(3-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-butyl-5-[(3-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-butyl-5-[(3-phenoxyphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-butyl-5-[(3-phenoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-butyl-5-[(3-phenoxybenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C19H22N4OS/c1-2-3-12-18-21-22-19(23(18)20)25-14-15-8-7-11-17(13-15)24-16-9-5-4-6-10-16/h4-11,13H,2-3,12,14,20H2,1H3