(2S)-N-(4-acetamido-3-chloranyl-phenyl)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(4-acetamido-3-chloranyl-phenyl)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(4-acetamido-3-chloro-phenyl)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: (2S)-N-(4-acetamido-3-chlorophenyl)-1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(4-acetamido-3-chlorophenyl)-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-(4-acetamido-3-chloro-phenyl)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C20H22ClN3O5S MolecularWeight: 451.92378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C20H22ClN3O5S/c1-13(25)22-18-10-5-14(12-17(18)21)23-20(26)19-4-3-11-24(19)30(27,28)16-8-6-15(29-2)7-9-16/h5-10,12,19H,3-4,11H2,1-2H3,(H,22,25)(H,23,26)/t19-/m0/s1