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

Systemtic Name: 5-(cyclopentylmethyl)-3-(phenylmethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-(cyclopentylmethyl)-1H-1,2,4-triazole CAS Name: 5-(cyclopentylmethyl)-3-(phenylmethylthio)-1H-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(cyclopentylmethyl)-1H-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-(cyclopentylmethyl)-1H-1,2,4-triazole Formula: C15H19N3S MolecularWeight: 273.39646

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC2=NC(=NN2)SCC3=CC=CC=C3

Isomeric SMILES

C1CCC(C1)CC2=NC(=NN2)SCC3=CC=CC=C3

InChI

InChI=1S/C15H19N3S/c1-2-8-13(9-3-1)11-19-15-16-14(17-18-15)10-12-6-4-5-7-12/h1-3,8-9,12H,4-7,10-11H2,(H,16,17,18)