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

Systemtic Name: 5-(phenylmethyl)-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-benzyl-3-benzylsulfanyl-1H-1,2,4-triazole CAS Name: 5-(phenylmethyl)-3-(phenylmethylthio)-1H-1,2,4-triazole IUPAC Name: 5-benzyl-3-benzylsulfanyl-1H-1,2,4-triazole Traditional Name: 5-benzyl-3-(benzylthio)-1H-1,2,4-triazole Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC(=NN2)SCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC(=NN2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H15N3S/c1-3-7-13(8-4-1)11-15-17-16(19-18-15)20-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,17,18,19)