(2S)-2-[(4-ethylphenyl)sulfonylamino]-5-(methylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-[(4-ethylphenyl)sulfonylamino]-5-(methylamino)-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-[(4-ethylphenyl)sulfonylamino]-5-(methylamino)-5-oxo-pentanoic acid CAS Name: (2S)-2-[(4-ethylphenyl)sulfonylamino]-5-(methylamino)-5-oxopentanoic acid IUPAC Name: (2S)-2-[(4-ethylphenyl)sulfonylamino]-5-(methylamino)-5-oxopentanoic acid Traditional Name: (2S)-2-[(4-ethylphenyl)sulfonylamino]-5-keto-5-(methylamino)valeric acid Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC(CCC(=O)NC)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CCC(=O)NC)C(=O)O

InChI

InChI=1S/C14H20N2O5S/c1-3-10-4-6-11(7-5-10)22(20,21)16-12(14(18)19)8-9-13(17)15-2/h4-7,12,16H,3,8-9H2,1-2H3,(H,15,17)(H,18,19)/t12-/m0/s1