(5-methyl-2-propan-2-yl-cyclohexyl) 2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetate CAS Name: 2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]acetic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]acetic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C17H29N3O3S MolecularWeight: 355.49546

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)OC2CC(CCC2C(C)C)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)OC2CC(CCC2C(C)C)C

InChI

InChI=1S/C17H29N3O3S/c1-5-8-20-16(22)18-19-17(20)24-10-15(21)23-14-9-12(4)6-7-13(14)11(2)3/h11-14H,5-10H2,1-4H3,(H,18,22)