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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=N1)CC(CCCSC2=CC3=CC=CC=C3C=C2)O

Isomeric SMILES

CCOC(=O)C1=CN(C=N1)CC(CCCSC2=CC3=CC=CC=C3C=C2)O

InChI

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