[3-(dicyanomethylidene)-2-oxidanylidene-indol-1-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [3-(dicyanomethylidene)-2-oxidanylidene-indol-1-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: [3-(dicyanomethylene)-2-oxo-indolin-1-yl]methyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid [3-(dicyanomethylidene)-2-oxo-1-indolyl]methyl ester IUPAC Name: [3-(dicyanomethylidene)-2-oxoindol-1-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid [3-(dicyanomethylene)-2-keto-indolin-1-yl]methyl ester Formula: C22H18N4O5S2 MolecularWeight: 482.53212

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCN2C3=CC=CC=C3C(=C(C#N)C#N)C2=O)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)OCN2C3=CC=CC=C3C(=C(C#N)C#N)C2=O)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H18N4O5S2/c23-12-16(13-24)20-17-4-1-2-5-18(17)26(21(20)27)14-31-22(28)15-7-9-25(10-8-15)33(29,30)19-6-3-11-32-19/h1-6,11,15H,7-10,14H2