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

Systemtic Name: 5-(cyclopentylmethyl)-3-(1-phenylethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-(cyclopentylmethyl)-3-(1-phenylethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(cyclopentylmethyl)-3-(1-phenylethylthio)-1H-1,2,4-triazole IUPAC Name: 5-(cyclopentylmethyl)-3-(1-phenylethylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-(cyclopentylmethyl)-3-(1-phenylethylthio)-1H-1,2,4-triazole Formula: C16H21N3S MolecularWeight: 287.42304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=NNC(=N2)CC3CCCC3

Isomeric SMILES

CC(C1=CC=CC=C1)SC2=NNC(=N2)CC3CCCC3

InChI

InChI=1S/C16H21N3S/c1-12(14-9-3-2-4-10-14)20-16-17-15(18-19-16)11-13-7-5-6-8-13/h2-4,9-10,12-13H,5-8,11H2,1H3,(H,17,18,19)