ethyl 2-butyl-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanyl-1H-imidazole-5-carboxylate

Systemtic Name: ethyl 2-butyl-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanyl-1H-imidazole-5-carboxylate Openeye Name: ethyl 4-(2-tert-butoxy-2-oxo-ethyl)sulfanyl-2-butyl-1H-imidazole-5-carboxylate CAS Name: 2-butyl-4-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]thio]-1H-imidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]sulfanyl-1H-imidazole-5-carboxylate Traditional Name: 4-[(2-tert-butoxy-2-keto-ethyl)thio]-2-butyl-1H-imidazole-5-carboxylic acid ethyl ester Formula: C16H26N2O4S MolecularWeight: 342.45364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1)C(=O)OCC)SCC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=NC(=C(N1)C(=O)OCC)SCC(=O)OC(C)(C)C

InChI

InChI=1S/C16H26N2O4S/c1-6-8-9-11-17-13(15(20)21-7-2)14(18-11)23-10-12(19)22-16(3,4)5/h6-10H2,1-5H3,(H,17,18)