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

Systemtic Name: methyl 3-(1H-imidazol-5-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: methyl 3-(1H-imidazol-5-yl)-2-(p-tolylsulfonylamino)propanoate CAS Name: 3-(1H-imidazol-5-yl)-2-[(4-methylphenyl)sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 3-(1H-imidazol-5-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(1H-imidazol-5-yl)-2-(tosylamino)propionic acid methyl ester Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CN=CN2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CN=CN2)C(=O)OC

InChI

InChI=1S/C14H17N3O4S/c1-10-3-5-12(6-4-10)22(19,20)17-13(14(18)21-2)7-11-8-15-9-16-11/h3-6,8-9,13,17H,7H2,1-2H3,(H,15,16)