ethyl 1-(1-naphthalen-1-ylsulfanyl-3-oxidanyl-butan-2-yl)imidazole-4-carboxylate

Systemtic Name: ethyl 1-(1-naphthalen-1-ylsulfanyl-3-oxidanyl-butan-2-yl)imidazole-4-carboxylate Openeye Name: ethyl 1-[2-hydroxy-1-(1-naphthylsulfanylmethyl)propyl]imidazole-4-carboxylate CAS Name: 1-[3-hydroxy-1-(1-naphthalenylthio)butan-2-yl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-hydroxy-1-naphthalen-1-ylsulfanylbutan-2-yl)imidazole-4-carboxylate Traditional Name: 1-[2-hydroxy-1-[(1-naphthylthio)methyl]propyl]imidazole-4-carboxylic acid ethyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C=N1)C(CSC2=CC=CC3=CC=CC=C32)C(C)O

Isomeric SMILES

CCOC(=O)C1=CN(C=N1)C(CSC2=CC=CC3=CC=CC=C32)C(C)O

InChI

InChI=1S/C20H22N2O3S/c1-3-25-20(24)17-11-22(13-21-17)18(14(2)23)12-26-19-10-6-8-15-7-4-5-9-16(15)19/h4-11,13-14,18,23H,3,12H2,1-2H3