[2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate

Systemtic Name: [2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-2-oxidanylidene-ethyl] 1-methylpyrazole-4-carboxylate Openeye Name: [2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-2-oxo-ethyl] 1-methylpyrazole-4-carboxylate CAS Name: 1-methyl-4-pyrazolecarboxylic acid [2-[[[[(1R,2R,3S)-2,3-dimethylcyclohexyl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-2-oxoethyl] 1-methylpyrazole-4-carboxylate Traditional Name: 1-methylpyrazole-4-carboxylic acid [2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]carbamoylamino]-2-keto-ethyl] ester Formula: C16H24N4O4 MolecularWeight: 336.38616

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)NC(=O)COC(=O)C2=CN(N=C2)C

Isomeric SMILES

C[C@H]1CCC[C@H]([C@@H]1C)NC(=O)NC(=O)COC(=O)C2=CN(N=C2)C

InChI

InChI=1S/C16H24N4O4/c1-10-5-4-6-13(11(10)2)18-16(23)19-14(21)9-24-15(22)12-7-17-20(3)8-12/h7-8,10-11,13H,4-6,9H2,1-3H3,(H2,18,19,21,23)/t10-,11+,13+/m0/s1