tert-butyl N-[(E)-6-azanyl-6-oxidanylidene-1-(phenylsulfonyl)hex-1-en-3-yl]carbamate

Systemtic Name: tert-butyl N-[(E)-6-azanyl-6-oxidanylidene-1-(phenylsulfonyl)hex-1-en-3-yl]carbamate Openeye Name: tert-butyl N-[4-amino-1-[(E)-2-(benzenesulfonyl)vinyl]-4-oxo-butyl]carbamate CAS Name: N-[(E)-6-amino-1-(benzenesulfonyl)-6-oxohex-1-en-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-6-amino-1-(benzenesulfonyl)-6-oxohex-1-en-3-yl]carbamate Traditional Name: N-[(E)-1-(3-amino-3-keto-propyl)-3-besyl-allyl]carbamic acid tert-butyl ester Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)N)C=CS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC(=O)N)/C=C/S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C17H24N2O5S/c1-17(2,3)24-16(21)19-13(9-10-15(18)20)11-12-25(22,23)14-7-5-4-6-8-14/h4-8,11-13H,9-10H2,1-3H3,(H2,18,20)(H,19,21)/b12-11+