(2R)-N-(3-benzamidopropyl)-1-(4-tert-butylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(3-benzamidopropyl)-1-(4-tert-butylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(3-benzamidopropyl)-1-(4-tert-butylphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: (2R)-N-(3-benzamidopropyl)-1-(4-tert-butylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(3-benzamidopropyl)-1-(4-tert-butylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2R)-N-(3-benzamidopropyl)-1-(4-tert-butylphenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C25H33N3O4S MolecularWeight: 471.61222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NCCCNC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H]2C(=O)NCCCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O4S/c1-25(2,3)20-12-14-21(15-13-20)33(31,32)28-18-7-11-22(28)24(30)27-17-8-16-26-23(29)19-9-5-4-6-10-19/h4-6,9-10,12-15,22H,7-8,11,16-18H2,1-3H3,(H,26,29)(H,27,30)/t22-/m1/s1