ethyl 1-(5-naphthalen-1-ylsulfanyl-2-oxidanyl-pentyl)imidazole-4-carboxylate

Systemtic Name: ethyl 1-(5-naphthalen-1-ylsulfanyl-2-oxidanyl-pentyl)imidazole-4-carboxylate Openeye Name: ethyl 1-[2-hydroxy-5-(1-naphthylsulfanyl)pentyl]imidazole-4-carboxylate CAS Name: 1-[2-hydroxy-5-(1-naphthalenylthio)pentyl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-hydroxy-5-naphthalen-1-ylsulfanylpentyl)imidazole-4-carboxylate Traditional Name: 1-[2-hydroxy-5-(1-naphthylthio)pentyl]imidazole-4-carboxylic acid ethyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=N1)CC(CCCSC2=CC=CC3=CC=CC=C32)O

Isomeric SMILES

CCOC(=O)C1=CN(C=N1)CC(CCCSC2=CC=CC3=CC=CC=C32)O

InChI

InChI=1S/C21H24N2O3S/c1-2-26-21(25)19-14-23(15-22-19)13-17(24)9-6-12-27-20-11-5-8-16-7-3-4-10-18(16)20/h3-5,7-8,10-11,14-15,17,24H,2,6,9,12-13H2,1H3