[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] 2-[(5-chloro-2-thienyl)methylsulfanyl]acetate CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]acetic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]acetic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C16H19ClN2O3S2 MolecularWeight: 386.91666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)COC(=O)CSCC2=CC=C(S2)Cl

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)COC(=O)CSCC2=CC=C(S2)Cl

InChI

InChI=1S/C16H19ClN2O3S2/c17-13-5-4-12(24-13)9-23-10-15(21)22-8-14(20)19-16(11-18)6-2-1-3-7-16/h4-5H,1-3,6-10H2,(H,19,20)