[2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxidanylidene-ethyl] 2-phenylsulfanylethanoate

Systemtic Name: [2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxidanylidene-ethyl] 2-phenylsulfanylethanoate Openeye Name: [2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxo-ethyl] 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [2-[[[[(1R,2S)-2-methylcyclohexyl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]-2-oxoethyl] 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid [2-keto-2-[[(1R,2S)-2-methylcyclohexyl]carbamoylamino]ethyl] ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)COC(=O)CSC2=CC=CC=C2

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)NC(=O)COC(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C18H24N2O4S/c1-13-7-5-6-10-15(13)19-18(23)20-16(21)11-24-17(22)12-25-14-8-3-2-4-9-14/h2-4,8-9,13,15H,5-7,10-12H2,1H3,(H2,19,20,21,23)/t13-,15+/m0/s1