3-(3-ethoxyphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(3-ethoxyphenyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-benzylsulfanyl-5-(3-ethoxyphenyl)-1,2,4-triazol-4-amine CAS Name: 3-(3-ethoxyphenyl)-5-(phenylmethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-benzylsulfanyl-5-(3-ethoxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-(benzylthio)-5-m-phenetyl-1,2,4-triazol-4-yl]amine Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=CC=C3

InChI

InChI=1S/C17H18N4OS/c1-2-22-15-10-6-9-14(11-15)16-19-20-17(21(16)18)23-12-13-7-4-3-5-8-13/h3-11H,2,12,18H2,1H3