3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-[methyl(p-tolylsulfonyl)amino]acetate CAS Name: 2-[methyl-(4-methylphenyl)sulfonylamino]acetic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[methyl(tosyl)amino]acetic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OCCCN2C3=CC=CC=C3NC2=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OCCCN2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C20H23N3O5S/c1-15-8-10-16(11-9-15)29(26,27)22(2)14-19(24)28-13-5-12-23-18-7-4-3-6-17(18)21-20(23)25/h3-4,6-11H,5,12-14H2,1-2H3,(H,21,25)