propan-2-yl 3-(2-chlorophenyl)-3-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrol-2-yl)carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-chlorophenyl)-3-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrol-2-yl)carbonylamino]propanoate Openeye Name: isopropyl 3-(2-chlorophenyl)-3-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carbonyl)amino]propanoate CAS Name: 3-(2-chlorophenyl)-3-[[oxo-[4-(1-pyrrolidinylsulfonyl)-1H-pyrrol-2-yl]methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-chlorophenyl)-3-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carbonyl)amino]propanoate Traditional Name: 3-(2-chlorophenyl)-3-[(4-pyrrolidinosulfonyl-1H-pyrrole-2-carbonyl)amino]propionic acid isopropyl ester Formula: C21H26ClN3O5S MolecularWeight: 467.96624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C2=CC(=CN2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C2=CC(=CN2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H26ClN3O5S/c1-14(2)30-20(26)12-18(16-7-3-4-8-17(16)22)24-21(27)19-11-15(13-23-19)31(28,29)25-9-5-6-10-25/h3-4,7-8,11,13-14,18,23H,5-6,9-10,12H2,1-2H3,(H,24,27)