butoxycarbonyl 3-(1H-imidazol-5-yl)-2-[methyl-(4-methylphenyl)sulfonyl-amino]propanoate

Systemtic Name: butoxycarbonyl 3-(1H-imidazol-5-yl)-2-[methyl-(4-methylphenyl)sulfonyl-amino]propanoate Openeye Name: butoxycarbonyl 3-(1H-imidazol-5-yl)-2-[methyl(p-tolylsulfonyl)amino]propanoate CAS Name: 3-(1H-imidazol-5-yl)-2-[methyl-(4-methylphenyl)sulfonylamino]propanoic acid [butoxy(oxo)methyl] ester IUPAC Name: butoxycarbonyl 3-(1H-imidazol-5-yl)-2-[methyl-(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(1H-imidazol-5-yl)-2-[methyl(tosyl)amino]propionic acid butoxycarbonyl ester Formula: C19H25N3O6S MolecularWeight: 423.4833

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)OC(=O)C(CC1=CN=CN1)N(C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCOC(=O)OC(=O)C(CC1=CN=CN1)N(C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H25N3O6S/c1-4-5-10-27-19(24)28-18(23)17(11-15-12-20-13-21-15)22(3)29(25,26)16-8-6-14(2)7-9-16/h6-9,12-13,17H,4-5,10-11H2,1-3H3,(H,20,21)