[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate CAS Name: 4-cyano-2-methyl-5-(1-pyrrolyl)-3-furancarboxylic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] 4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carboxylate Traditional Name: 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=C(OC(=C1C#N)N2C=CC=C2)C

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)C1=C(OC(=C1C#N)N2C=CC=C2)C

InChI

InChI=1S/C17H19N3O4/c1-4-7-19-15(21)12(3)24-17(22)14-11(2)23-16(13(14)10-18)20-8-5-6-9-20/h5-6,8-9,12H,4,7H2,1-3H3,(H,19,21)/t12-/m0/s1