N-[(4-cyanophenyl)methyl]-1-[2-cyclohexyl-2-(methylsulfonylamino)ethanoyl]pyrrolidine-2-carboxamide

Systemtic Name: N-[(4-cyanophenyl)methyl]-1-[2-cyclohexyl-2-(methylsulfonylamino)ethanoyl]pyrrolidine-2-carboxamide Openeye Name: N-[(4-cyanophenyl)methyl]-1-[2-cyclohexyl-2-(methanesulfonamido)acetyl]pyrrolidine-2-carboxamide CAS Name: N-[(4-cyanophenyl)methyl]-1-[2-cyclohexyl-2-(methanesulfonamido)-1-oxoethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[(4-cyanophenyl)methyl]-1-[2-cyclohexyl-2-(methanesulfonamido)acetyl]pyrrolidine-2-carboxamide Traditional Name: N-(4-cyanobenzyl)-1-[2-cyclohexyl-2-(methanesulfonamido)acetyl]pyrrolidine-2-carboxamide Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(C1CCCCC1)C(=O)N2CCCC2C(=O)NCC3=CC=C(C=C3)C#N

Isomeric SMILES

CS(=O)(=O)NC(C1CCCCC1)C(=O)N2CCCC2C(=O)NCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H30N4O4S/c1-31(29,30)25-20(18-6-3-2-4-7-18)22(28)26-13-5-8-19(26)21(27)24-15-17-11-9-16(14-23)10-12-17/h9-12,18-20,25H,2-8,13,15H2,1H3,(H,24,27)