ethyl 2-[4-cyclohexyl-5-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[4-cyclohexyl-5-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethanoate Openeye Name: ethyl 2-[4-cyclohexyl-5-[2-(2-methoxyethylamino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]acetate CAS Name: 2-[4-cyclohexyl-5-[[2-(2-methoxyethylamino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-cyclohexyl-5-[2-(2-methoxyethylamino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]acetate Traditional Name: 2-[4-cyclohexyl-5-[[2-keto-2-(2-methoxyethylamino)ethyl]thio]-1,2,4-triazol-3-yl]acetic acid ethyl ester Formula: C17H28N4O4S MolecularWeight: 384.49362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(N1C2CCCCC2)SCC(=O)NCCOC

Isomeric SMILES

CCOC(=O)CC1=NN=C(N1C2CCCCC2)SCC(=O)NCCOC

InChI

InChI=1S/C17H28N4O4S/c1-3-25-16(23)11-14-19-20-17(21(14)13-7-5-4-6-8-13)26-12-15(22)18-9-10-24-2/h13H,3-12H2,1-2H3,(H,18,22)