[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 4-phenyl-2-(thiophen-2-ylcarbonylamino)thiophene-3-carboxylate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 4-phenyl-2-(thiophen-2-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 4-phenyl-2-(thiophene-2-carbonylamino)thiophene-3-carboxylate CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]-4-phenyl-3-thiophenecarboxylic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 4-phenyl-2-(thiophene-2-carbonylamino)thiophene-3-carboxylate Traditional Name: 4-phenyl-2-(2-thenoylamino)thiophene-3-carboxylic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C24H21N3O4S2 MolecularWeight: 479.57124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)COC(=O)C2=C(SC=C2C3=CC=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)COC(=O)C2=C(SC=C2C3=CC=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C24H21N3O4S2/c25-15-24(10-4-5-11-24)27-19(28)13-31-23(30)20-17(16-7-2-1-3-8-16)14-33-22(20)26-21(29)18-9-6-12-32-18/h1-3,6-9,12,14H,4-5,10-11,13H2,(H,26,29)(H,27,28)