tert-butyl N-[(4-iodophenyl)methyl]-N-[(E)-N-[(2-methylpropan-2-yl)oxycarbonyl]-C-methylsulfanyl-carbonimidoyl]carbamate

Systemtic Name: tert-butyl N-[(4-iodophenyl)methyl]-N-[(E)-N-[(2-methylpropan-2-yl)oxycarbonyl]-C-methylsulfanyl-carbonimidoyl]carbamate Openeye Name: tert-butyl N-[(E)-N-tert-butoxycarbonyl-C-methylsulfanyl-carbonimidoyl]-N-[(4-iodophenyl)methyl]carbamate CAS Name: N-[(4-iodophenyl)methyl]-N-[(E)-[(2-methylpropan-2-yl)oxy-oxomethyl]imino-(methylthio)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4-iodophenyl)methyl]-N-[(E)-N-[(2-methylpropan-2-yl)oxycarbonyl]-C-methylsulfanylcarbonimidoyl]carbamate Traditional Name: N-[(E)-N-tert-butoxycarbonyl-C-(methylthio)carbonimidoyl]-N-(4-iodobenzyl)carbamic acid tert-butyl ester Formula: C19H27IN2O4S MolecularWeight: 506.39815

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N=C(N(CC1=CC=C(C=C1)I)C(=O)OC(C)(C)C)SC

Isomeric SMILES

CC(C)(C)OC(=O)/N=C(\N(CC1=CC=C(C=C1)I)C(=O)OC(C)(C)C)/SC

InChI

InChI=1S/C19H27IN2O4S/c1-18(2,3)25-16(23)21-15(27-7)22(17(24)26-19(4,5)6)12-13-8-10-14(20)11-9-13/h8-11H,12H2,1-7H3/b21-15+