3-cyclohexylsulfanyl-5-ethyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-cyclohexylsulfanyl-5-ethyl-4-phenyl-1,2,4-triazole Openeye Name: 3-cyclohexylsulfanyl-5-ethyl-4-phenyl-1,2,4-triazole CAS Name: 3-(cyclohexylthio)-5-ethyl-4-phenyl-1,2,4-triazole IUPAC Name: 3-cyclohexylsulfanyl-5-ethyl-4-phenyl-1,2,4-triazole Traditional Name: 3-(cyclohexylthio)-5-ethyl-4-phenyl-1,2,4-triazole Formula: C16H21N3S MolecularWeight: 287.42304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2)SC3CCCCC3

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2)SC3CCCCC3

InChI

InChI=1S/C16H21N3S/c1-2-15-17-18-16(20-14-11-7-4-8-12-14)19(15)13-9-5-3-6-10-13/h3,5-6,9-10,14H,2,4,7-8,11-12H2,1H3