methyl 3-(1H-imidazol-5-yl)-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-(1H-imidazol-5-yl)-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]propanoate Openeye Name: methyl 3-(1H-imidazol-5-yl)-2-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]propanoate CAS Name: 3-(1H-imidazol-5-yl)-2-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(1H-imidazol-5-yl)-2-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]propanoate Traditional Name: 3-(1H-imidazol-5-yl)-2-[(1-tosylprolyl)amino]propionic acid methyl ester Formula: C19H24N4O5S MolecularWeight: 420.48266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CC3=CN=CN3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CC3=CN=CN3)C(=O)OC

InChI

InChI=1S/C19H24N4O5S/c1-13-5-7-15(8-6-13)29(26,27)23-9-3-4-17(23)18(24)22-16(19(25)28-2)10-14-11-20-12-21-14/h5-8,11-12,16-17H,3-4,9-10H2,1-2H3,(H,20,21)(H,22,24)