methyl (E,2R)-2-[hexylsulfanyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-3-enoate

Systemtic Name: methyl (E,2R)-2-[hexylsulfanyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-3-enoate Openeye Name: methyl (E,2R)-2-[tert-butoxycarbonyl(hexylsulfanyl)amino]pent-3-enoate CAS Name: (E,2R)-2-[(hexylthio)-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pentenoic acid methyl ester IUPAC Name: methyl (E,2R)-2-[hexylsulfanyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-3-enoate Traditional Name: (E,2R)-2-[tert-butoxycarbonyl-(hexylthio)amino]pent-3-enoic acid methyl ester Formula: C17H31NO4S MolecularWeight: 345.49734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSN(C(C=CC)C(=O)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCSN([C@H](/C=C/C)C(=O)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H31NO4S/c1-7-9-10-11-13-23-18(16(20)22-17(3,4)5)14(12-8-2)15(19)21-6/h8,12,14H,7,9-11,13H2,1-6H3/b12-8+/t14-/m1/s1