ethyl (2S)-2-[[(2S)-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl (2S)-2-[[(2S)-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: ethyl (2S)-2-[[(2S)-5-oxo-1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[(2S)-1-(4-methylphenyl)sulfonyl-5-oxo-2-pyrrolidinyl]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[(2S)-1-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2S)-5-keto-1-tosyl-prolyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2CCC(=O)N2S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]2CCC(=O)N2S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H26N2O6S/c1-3-31-23(28)19(15-17-7-5-4-6-8-17)24-22(27)20-13-14-21(26)25(20)32(29,30)18-11-9-16(2)10-12-18/h4-12,19-20H,3,13-15H2,1-2H3,(H,24,27)/t19-,20-/m0/s1