methyl 2-[[2-(1,3-benzothiazol-2-ylsulfonylamino)-2-phenyl-ethanoyl]amino]propanoate

Systemtic Name: methyl 2-[[2-(1,3-benzothiazol-2-ylsulfonylamino)-2-phenyl-ethanoyl]amino]propanoate Openeye Name: methyl 2-[[2-(1,3-benzothiazol-2-ylsulfonylamino)-2-phenyl-acetyl]amino]propanoate CAS Name: 2-[[2-(1,3-benzothiazol-2-ylsulfonylamino)-1-oxo-2-phenylethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[2-(1,3-benzothiazol-2-ylsulfonylamino)-2-phenylacetyl]amino]propanoate Traditional Name: 2-[[2-(1,3-benzothiazol-2-ylsulfonylamino)-2-phenyl-acetyl]amino]propionic acid methyl ester Formula: C19H19N3O5S2 MolecularWeight: 433.50126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C(C1=CC=CC=C1)NS(=O)(=O)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C(=O)OC)NC(=O)C(C1=CC=CC=C1)NS(=O)(=O)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N3O5S2/c1-12(18(24)27-2)20-17(23)16(13-8-4-3-5-9-13)22-29(25,26)19-21-14-10-6-7-11-15(14)28-19/h3-12,16,22H,1-2H3,(H,20,23)