methyl (2R,4S)-1-(4-methoxyphenyl)sulfonyl-4-[2-methylpropanoyl(pyridin-3-ylmethyl)amino]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4S)-1-(4-methoxyphenyl)sulfonyl-4-[2-methylpropanoyl(pyridin-3-ylmethyl)amino]pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4S)-1-(4-methoxyphenyl)sulfonyl-4-[2-methylpropanoyl(3-pyridylmethyl)amino]pyrrolidine-2-carboxylate CAS Name: (2R,4S)-1-(4-methoxyphenyl)sulfonyl-4-[(2-methyl-1-oxopropyl)-(3-pyridinylmethyl)amino]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-1-(4-methoxyphenyl)sulfonyl-4-[2-methylpropanoyl(pyridin-3-ylmethyl)amino]pyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-[isobutyryl(3-pyridylmethyl)amino]-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N(CC1=CN=CC=C1)C2CC(N(C2)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CC(C)C(=O)N(CC1=CN=CC=C1)[C@H]2C[C@@H](N(C2)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C23H29N3O6S/c1-16(2)22(27)25(14-17-6-5-11-24-13-17)18-12-21(23(28)32-4)26(15-18)33(29,30)20-9-7-19(31-3)8-10-20/h5-11,13,16,18,21H,12,14-15H2,1-4H3/t18-,21+/m0/s1