(2S)-2-benzamido-5-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-benzamido-5-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-benzamido-5-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-5-oxo-pentanoic acid CAS Name: (2S)-2-benzamido-5-[4-(4-methoxy-3-methylphenyl)sulfonyl-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: (2S)-2-benzamido-5-[4-(4-methoxy-3-methylphenyl)sulfonylpiperazin-1-yl]-5-oxopentanoic acid Traditional Name: (2S)-2-benzamido-5-keto-5-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazino]valeric acid Formula: C24H29N3O7S MolecularWeight: 503.56796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(C(=O)O)NC(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC[C@@H](C(=O)O)NC(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C24H29N3O7S/c1-17-16-19(8-10-21(17)34-2)35(32,33)27-14-12-26(13-15-27)22(28)11-9-20(24(30)31)25-23(29)18-6-4-3-5-7-18/h3-8,10,16,20H,9,11-15H2,1-2H3,(H,25,29)(H,30,31)/t20-/m0/s1