cyclohexyl 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoate

Systemtic Name: cyclohexyl 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: cyclohexyl 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetate CAS Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetic acid cyclohexyl ester Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)OC2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)OC2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3O2S/c1-20-16(13-8-4-2-5-9-13)18-19-17(20)23-12-15(21)22-14-10-6-3-7-11-14/h2,4-5,8-9,14H,3,6-7,10-12H2,1H3