ethyl 2-[5-[9-(pyridin-2-ylmethylcarbamoyl)fluoren-9-yl]pentylsulfanyl]-1H-imidazole-5-carboxylate

Systemtic Name: ethyl 2-[5-[9-(pyridin-2-ylmethylcarbamoyl)fluoren-9-yl]pentylsulfanyl]-1H-imidazole-5-carboxylate Openeye Name: ethyl 2-[5-[9-(2-pyridylmethylcarbamoyl)fluoren-9-yl]pentylsulfanyl]-1H-imidazole-5-carboxylate CAS Name: 2-[5-[9-[oxo-(2-pyridinylmethylamino)methyl]-9-fluorenyl]pentylthio]-1H-imidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[5-[9-(pyridin-2-ylmethylcarbamoyl)fluoren-9-yl]pentylsulfanyl]-1H-imidazole-5-carboxylate Traditional Name: 2-[5-[9-(2-pyridylmethylcarbamoyl)fluoren-9-yl]pentylthio]-1H-imidazole-5-carboxylic acid ethyl ester Formula: C31H32N4O3S MolecularWeight: 540.67578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N1)SCCCCCC2(C3=CC=CC=C3C4=CC=CC=C42)C(=O)NCC5=CC=CC=N5

Isomeric SMILES

CCOC(=O)C1=CN=C(N1)SCCCCCC2(C3=CC=CC=C3C4=CC=CC=C42)C(=O)NCC5=CC=CC=N5

InChI

InChI=1S/C31H32N4O3S/c1-2-38-28(36)27-21-34-30(35-27)39-19-11-3-9-17-31(29(37)33-20-22-12-8-10-18-32-22)25-15-6-4-13-23(25)24-14-5-7-16-26(24)31/h4-8,10,12-16,18,21H,2-3,9,11,17,19-20H2,1H3,(H,33,37)(H,34,35)