3-ethylsulfanyl-5-(phenylmethyl)-1H-1,2,4-triazole

Systemtic Name: 3-ethylsulfanyl-5-(phenylmethyl)-1H-1,2,4-triazole Openeye Name: 5-benzyl-3-ethylsulfanyl-1H-1,2,4-triazole CAS Name: 3-(ethylthio)-5-(phenylmethyl)-1H-1,2,4-triazole IUPAC Name: 5-benzyl-3-ethylsulfanyl-1H-1,2,4-triazole Traditional Name: 5-benzyl-3-(ethylthio)-1H-1,2,4-triazole Formula: C11H13N3S MolecularWeight: 219.30602

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NNC(=N1)CC2=CC=CC=C2

Isomeric SMILES

CCSC1=NNC(=N1)CC2=CC=CC=C2

InChI

InChI=1S/C11H13N3S/c1-2-15-11-12-10(13-14-11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,13,14)