tert-butyl [(2-methylpropan-2-yl)oxycarbonyl-[(E)-3-(2-prop-2-ynylsulfanylphenyl)prop-2-enyl]amino] carbonate

Systemtic Name: tert-butyl [(2-methylpropan-2-yl)oxycarbonyl-[(E)-3-(2-prop-2-ynylsulfanylphenyl)prop-2-enyl]amino] carbonate Openeye Name: [tert-butoxycarbonyl-[(E)-3-(2-prop-2-ynylsulfanylphenyl)allyl]amino] tert-butyl carbonate CAS Name: carbonic acid tert-butyl [[(2-methylpropan-2-yl)oxy-oxomethyl]-[(E)-3-[2-(prop-2-ynylthio)phenyl]prop-2-enyl]amino] ester IUPAC Name: tert-butyl [(2-methylpropan-2-yl)oxycarbonyl-[(E)-3-(2-prop-2-ynylsulfanylphenyl)prop-2-enyl]amino] carbonate Traditional Name: carbonic acid [tert-butoxycarbonyl-[(E)-3-[2-(propargylthio)phenyl]allyl]amino] tert-butyl ester Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC=CC1=CC=CC=C1SCC#C)OC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(C/C=C/C1=CC=CC=C1SCC#C)OC(=O)OC(C)(C)C

InChI

InChI=1S/C22H29NO5S/c1-8-16-29-18-14-10-9-12-17(18)13-11-15-23(19(24)26-21(2,3)4)28-20(25)27-22(5,6)7/h1,9-14H,15-16H2,2-7H3/b13-11+