[2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-[(2-chlorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-[(2-chlorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-(4-morpholinosulfonylanilino)-2-oxo-ethyl] (2S)-2-[(2-chlorobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2-chlorophenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-[4-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] (2S)-2-[(2-chlorobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2-chlorobenzoyl)amino]-3-methyl-butyric acid [2-keto-2-(4-morpholinosulfonylanilino)ethyl] ester Formula: C24H28ClN3O7S MolecularWeight: 538.01302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C24H28ClN3O7S/c1-16(2)22(27-23(30)19-5-3-4-6-20(19)25)24(31)35-15-21(29)26-17-7-9-18(10-8-17)36(32,33)28-11-13-34-14-12-28/h3-10,16,22H,11-15H2,1-2H3,(H,26,29)(H,27,30)/t22-/m0/s1