methyl (2S,3S)-3-methyl-2-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]pentanoate

Systemtic Name: methyl (2S,3S)-3-methyl-2-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]pentanoate Openeye Name: methyl (2S,3S)-3-methyl-2-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]pentanoate CAS Name: (2S,3S)-3-methyl-2-[[[2-methyl-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-methyl-2-[(2-methyl-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]pentanoate Traditional Name: (2S,3S)-3-methyl-2-[(2-methyl-5-pyrrolidinosulfonyl-benzoyl)amino]valeric acid methyl ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)C

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)C

InChI

InChI=1S/C19H28N2O5S/c1-5-13(2)17(19(23)26-4)20-18(22)16-12-15(9-8-14(16)3)27(24,25)21-10-6-7-11-21/h8-9,12-13,17H,5-7,10-11H2,1-4H3,(H,20,22)/t13-,17-/m0/s1