ethyl 2,4-dimethyl-5-[[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[[(2S)-1-oxo-1-(propylamino)propan-2-yl]amino]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[[(2S)-1-oxo-1-(propylamino)propan-2-yl]carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C16H25N3O4 MolecularWeight: 323.3874

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)C1=C(C(=C(N1)C)C(=O)OCC)C

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)C1=C(C(=C(N1)C)C(=O)OCC)C

InChI

InChI=1S/C16H25N3O4/c1-6-8-17-14(20)11(5)19-15(21)13-9(3)12(10(4)18-13)16(22)23-7-2/h11,18H,6-8H2,1-5H3,(H,17,20)(H,19,21)/t11-/m0/s1