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

Systemtic Name: 3-(methoxymethyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-benzylsulfanyl-5-(methoxymethyl)-1,2,4-triazol-4-amine CAS Name: 3-(methoxymethyl)-5-(phenylmethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-benzylsulfanyl-5-(methoxymethyl)-1,2,4-triazol-4-amine Traditional Name: [3-(benzylthio)-5-(methoxymethyl)-1,2,4-triazol-4-yl]amine Formula: C11H14N4OS MolecularWeight: 250.32006

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NN=C(N1N)SCC2=CC=CC=C2

Isomeric SMILES

COCC1=NN=C(N1N)SCC2=CC=CC=C2

InChI

InChI=1S/C11H14N4OS/c1-16-7-10-13-14-11(15(10)12)17-8-9-5-3-2-4-6-9/h2-6H,7-8,12H2,1H3