4-cyclohexyl-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-cyclohexyl-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-cyclohexyl-3-(p-tolylmethylsulfanyl)-1H-1,2,4-triazol-5-one CAS Name: 4-cyclohexyl-3-[(4-methylphenyl)methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-cyclohexyl-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-cyclohexyl-3-[(4-methylbenzyl)thio]-1H-1,2,4-triazol-5-one Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NNC(=O)N2C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NNC(=O)N2C3CCCCC3

InChI

InChI=1S/C16H21N3OS/c1-12-7-9-13(10-8-12)11-21-16-18-17-15(20)19(16)14-5-3-2-4-6-14/h7-10,14H,2-6,11H2,1H3,(H,17,20)