3-cyclohexyl-4-ethyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-cyclohexyl-4-ethyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-cyclohexyl-4-ethyl-5-(1-naphthylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-cyclohexyl-4-ethyl-5-(1-naphthalenylmethylthio)-1,2,4-triazole IUPAC Name: 3-cyclohexyl-4-ethyl-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 3-cyclohexyl-4-ethyl-5-(1-naphthylmethylthio)-1,2,4-triazole Formula: C21H25N3S MolecularWeight: 351.5083

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)C4CCCCC4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)C4CCCCC4

InChI

InChI=1S/C21H25N3S/c1-2-24-20(17-10-4-3-5-11-17)22-23-21(24)25-15-18-13-8-12-16-9-6-7-14-19(16)18/h6-9,12-14,17H,2-5,10-11,15H2,1H3