tert-butyl (2S)-2-[(3-morpholin-4-ylsulfonylphenyl)carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(3-morpholin-4-ylsulfonylphenyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(3-morpholinosulfonylphenyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[3-(4-morpholinylsulfonyl)anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(3-morpholin-4-ylsulfonylphenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(3-morpholinosulfonylphenyl)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H29N3O6S MolecularWeight: 439.52576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H29N3O6S/c1-20(2,3)29-19(25)23-9-5-8-17(23)18(24)21-15-6-4-7-16(14-15)30(26,27)22-10-12-28-13-11-22/h4,6-7,14,17H,5,8-13H2,1-3H3,(H,21,24)/t17-/m0/s1