methyl 2-[(2-methylpropan-2-yl)oxycarbonyl-phenylsulfanyl-amino]but-3-enoate

Systemtic Name: methyl 2-[(2-methylpropan-2-yl)oxycarbonyl-phenylsulfanyl-amino]but-3-enoate Openeye Name: methyl 2-[tert-butoxycarbonyl(phenylsulfanyl)amino]but-3-enoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylthio)amino]-3-butenoic acid methyl ester IUPAC Name: methyl 2-[(2-methylpropan-2-yl)oxycarbonyl-phenylsulfanylamino]but-3-enoate Traditional Name: 2-[tert-butoxycarbonyl-(phenylthio)amino]but-3-enoic acid methyl ester Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(C=C)C(=O)OC)SC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)N(C(C=C)C(=O)OC)SC1=CC=CC=C1

InChI

InChI=1S/C16H21NO4S/c1-6-13(14(18)20-5)17(15(19)21-16(2,3)4)22-12-10-8-7-9-11-12/h6-11,13H,1H2,2-5H3