(2S)-4-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]pentanoic acid Openeye Name: (2S)-4-methyl-2-[(3-morpholinosulfonylbenzoyl)amino]pentanoic acid CAS Name: (2S)-4-methyl-2-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]pentanoic acid IUPAC Name: (2S)-4-methyl-2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]pentanoic acid Traditional Name: (2S)-4-methyl-2-[(3-morpholinosulfonylbenzoyl)amino]valeric acid Formula: C17H24N2O6S MolecularWeight: 384.44726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C17H24N2O6S/c1-12(2)10-15(17(21)22)18-16(20)13-4-3-5-14(11-13)26(23,24)19-6-8-25-9-7-19/h3-5,11-12,15H,6-10H2,1-2H3,(H,18,20)(H,21,22)/t15-/m0/s1