(2S)-2-azanyl-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-[4-(3,4-dichlorophenyl)sulfonylpiperazino]-5-keto-valeric acid Formula: C15H19Cl2N3O5S MolecularWeight: 424.29946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(C(=O)O)N)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CC[C@@H](C(=O)O)N)S(=O)(=O)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C15H19Cl2N3O5S/c16-11-2-1-10(9-12(11)17)26(24,25)20-7-5-19(6-8-20)14(21)4-3-13(18)15(22)23/h1-2,9,13H,3-8,18H2,(H,22,23)/t13-/m0/s1