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

Systemtic Name: ethyl 2-[4-cyclohexyl-5-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]ethanoate Openeye Name: ethyl 2-[4-cyclohexyl-5-[2-(cyclopropylamino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]acetate CAS Name: 2-[4-cyclohexyl-5-[[2-(cyclopropylamino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-cyclohexyl-5-[2-(cyclopropylamino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]acetate Traditional Name: 2-[4-cyclohexyl-5-[[2-(cyclopropylamino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]acetic acid ethyl ester Formula: C17H26N4O3S MolecularWeight: 366.47834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(N1C2CCCCC2)SCC(=O)NC3CC3

Isomeric SMILES

CCOC(=O)CC1=NN=C(N1C2CCCCC2)SCC(=O)NC3CC3

InChI

InChI=1S/C17H26N4O3S/c1-2-24-16(23)10-14-19-20-17(21(14)13-6-4-3-5-7-13)25-11-15(22)18-12-8-9-12/h12-13H,2-11H2,1H3,(H,18,22)