propan-2-yl (3S)-3-(2-chlorophenyl)-3-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]propanoate

Systemtic Name: propan-2-yl (3S)-3-(2-chlorophenyl)-3-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]propanoate Openeye Name: isopropyl (3S)-3-(2-chlorophenyl)-3-[(2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]propanoate CAS Name: (3S)-3-(2-chlorophenyl)-3-[[[2-methyl-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3S)-3-(2-chlorophenyl)-3-[(2-methyl-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]propanoate Traditional Name: (3S)-3-(2-chlorophenyl)-3-[(2-methyl-5-pyrrolidinosulfonyl-benzoyl)amino]propionic acid isopropyl ester Formula: C24H29ClN2O5S MolecularWeight: 493.01546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC(CC(=O)OC(C)C)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N[C@@H](CC(=O)OC(C)C)C3=CC=CC=C3Cl

InChI

InChI=1S/C24H29ClN2O5S/c1-16(2)32-23(28)15-22(19-8-4-5-9-21(19)25)26-24(29)20-14-18(11-10-17(20)3)33(30,31)27-12-6-7-13-27/h4-5,8-11,14,16,22H,6-7,12-13,15H2,1-3H3,(H,26,29)/t22-/m0/s1