tert-butyl 4-[3-(2-dimethylaminoethyloxy)-3-oxidanylidene-propyl]-2-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]imidazole-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(2-dimethylaminoethyloxy)-3-oxidanylidene-propyl]-2-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]imidazole-1-carboxylate Openeye Name: tert-butyl 2-tert-butoxycarbonylsulfanyl-4-[3-(2-dimethylaminoethyloxy)-3-oxo-propyl]imidazole-1-carboxylate CAS Name: 4-[3-(2-dimethylaminoethyloxy)-3-oxopropyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]thio]-1-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(2-dimethylaminoethyloxy)-3-oxopropyl]-2-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]imidazole-1-carboxylate Traditional Name: 2-(tert-butoxycarbonylthio)-4-[3-(2-dimethylaminoethyloxy)-3-keto-propyl]imidazole-1-carboxylic acid tert-butyl ester Formula: C20H33N3O6S MolecularWeight: 443.55752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(N=C1SC(=O)OC(C)(C)C)CCC(=O)OCCN(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(N=C1SC(=O)OC(C)(C)C)CCC(=O)OCCN(C)C

InChI

InChI=1S/C20H33N3O6S/c1-19(2,3)28-17(25)23-13-14(9-10-15(24)27-12-11-22(7)8)21-16(23)30-18(26)29-20(4,5)6/h13H,9-12H2,1-8H3