3-(cyclohexylmethylsulfanyl)-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(cyclohexylmethylsulfanyl)-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-(cyclohexylmethylsulfanyl)-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-(cyclohexylmethylthio)-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-(cyclohexylmethylsulfanyl)-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-(cyclohexylmethylthio)-4-propyl-1H-1,2,4-triazol-5-one Formula: C12H21N3OS MolecularWeight: 255.37964

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2CCCCC2

Isomeric SMILES

CCCN1C(=O)NN=C1SCC2CCCCC2

InChI

InChI=1S/C12H21N3OS/c1-2-8-15-11(16)13-14-12(15)17-9-10-6-4-3-5-7-10/h10H,2-9H2,1H3,(H,13,16)