ethyl 3-[1-(4-cyano-3-pyrrol-1-yl-thiophen-2-yl)carbonylpiperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: ethyl 3-[1-(4-cyano-3-pyrrol-1-yl-thiophen-2-yl)carbonylpiperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: ethyl 3-[1-(4-cyano-3-pyrrol-1-yl-thiophene-2-carbonyl)-4-piperidyl]-2-oxo-oxazolidine-4-carboxylate CAS Name: 3-[1-[[4-cyano-3-(1-pyrrolyl)-2-thiophenyl]-oxomethyl]-4-piperidinyl]-2-oxo-4-oxazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[1-(4-cyano-3-pyrrol-1-ylthiophene-2-carbonyl)piperidin-4-yl]-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 3-[1-(4-cyano-3-pyrrol-1-yl-thiophene-2-carbonyl)-4-piperidyl]-2-keto-oxazolidine-4-carboxylic acid ethyl ester Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1COC(=O)N1C2CCN(CC2)C(=O)C3=C(C(=CS3)C#N)N4C=CC=C4

Isomeric SMILES

CCOC(=O)C1COC(=O)N1C2CCN(CC2)C(=O)C3=C(C(=CS3)C#N)N4C=CC=C4

InChI

InChI=1S/C21H22N4O5S/c1-2-29-20(27)16-12-30-21(28)25(16)15-5-9-24(10-6-15)19(26)18-17(14(11-22)13-31-18)23-7-3-4-8-23/h3-4,7-8,13,15-16H,2,5-6,9-10,12H2,1H3