ethyl 2-[3-[4-(4-methylphenyl)sulfonylimidazol-1-yl]propanoylamino]ethanoate

Systemtic Name: ethyl 2-[3-[4-(4-methylphenyl)sulfonylimidazol-1-yl]propanoylamino]ethanoate Openeye Name: ethyl 2-[3-[4-(p-tolylsulfonyl)imidazol-1-yl]propanoylamino]acetate CAS Name: 2-[[3-[4-(4-methylphenyl)sulfonyl-1-imidazolyl]-1-oxopropyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[4-(4-methylphenyl)sulfonylimidazol-1-yl]propanoylamino]acetate Traditional Name: 2-[3-(4-tosylimidazol-1-yl)propanoylamino]acetic acid ethyl ester Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CCN1C=C(N=C1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CNC(=O)CCN1C=C(N=C1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H21N3O5S/c1-3-25-17(22)10-18-15(21)8-9-20-11-16(19-12-20)26(23,24)14-6-4-13(2)5-7-14/h4-7,11-12H,3,8-10H2,1-2H3,(H,18,21)