2-[3-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]propanoic acid

Systemtic Name: 2-[3-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]propanoic acid Openeye Name: 2-[3-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]-2-oxo-pyrrolidin-1-yl]propanoic acid CAS Name: 2-[3-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-oxo-1-pyrrolidinyl]propanoic acid IUPAC Name: 2-[3-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]propanoic acid Traditional Name: 2-[3-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]-2-keto-pyrrolidino]propionic acid Formula: C16H17ClN2O5S2 MolecularWeight: 416.89958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3CCN(C3=O)C(C)C(=O)O

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3CCN(C3=O)C(C)C(=O)O

InChI

InChI=1S/C16H17ClN2O5S2/c1-8-11-7-10(17)3-4-13(11)25-16(8)26(23,24)18-12-5-6-19(14(12)20)9(2)15(21)22/h3-4,7,9,12,18H,5-6H2,1-2H3,(H,21,22)