methyl (2R,4S)-1-(4-butoxyphenyl)sulfonyl-4-[(1-methylimidazol-4-yl)sulfonylamino]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4S)-1-(4-butoxyphenyl)sulfonyl-4-[(1-methylimidazol-4-yl)sulfonylamino]pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4S)-1-(4-butoxyphenyl)sulfonyl-4-[(1-methylimidazol-4-yl)sulfonylamino]pyrrolidine-2-carboxylate CAS Name: (2R,4S)-1-(4-butoxyphenyl)sulfonyl-4-[(1-methyl-4-imidazolyl)sulfonylamino]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-1-(4-butoxyphenyl)sulfonyl-4-[(1-methylimidazol-4-yl)sulfonylamino]pyrrolidine-2-carboxylate Traditional Name: (2R,4S)-1-(4-butoxyphenyl)sulfonyl-4-[(1-methylimidazol-4-yl)sulfonylamino]pyrrolidine-2-carboxylic acid methyl ester Formula: C20H28N4O7S2 MolecularWeight: 500.58892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)OC)NS(=O)(=O)C3=CN(C=N3)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C[C@H](C[C@@H]2C(=O)OC)NS(=O)(=O)C3=CN(C=N3)C

InChI

InChI=1S/C20H28N4O7S2/c1-4-5-10-31-16-6-8-17(9-7-16)33(28,29)24-12-15(11-18(24)20(25)30-3)22-32(26,27)19-13-23(2)14-21-19/h6-9,13-15,18,22H,4-5,10-12H2,1-3H3/t15-,18+/m0/s1