[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methanamine

Systemtic Name: [4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methanamine Openeye Name: (5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methanamine CAS Name: [4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methanamine IUPAC Name: (5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methanamine Traditional Name: [5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]methylamine Formula: C11H14N4S MolecularWeight: 234.32066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)CN

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)CN

InChI

InChI=1S/C11H14N4S/c1-15-10(7-12)13-14-11(15)16-8-9-5-3-2-4-6-9/h2-6H,7-8,12H2,1H3