(2R)-1-(1-adamantylcarbonyl)-N-[4-(phenylcarbamoylamino)phenyl]pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-(1-adamantylcarbonyl)-N-[4-(phenylcarbamoylamino)phenyl]pyrrolidine-2-carboxamide Openeye Name: (2R)-1-(adamantane-1-carbonyl)-N-[4-(phenylcarbamoylamino)phenyl]pyrrolidine-2-carboxamide CAS Name: (2R)-1-[1-adamantyl(oxo)methyl]-N-[4-[[anilino(oxo)methyl]amino]phenyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(adamantane-1-carbonyl)-N-[4-(phenylcarbamoylamino)phenyl]pyrrolidine-2-carboxamide Traditional Name: (2R)-1-(adamantane-1-carbonyl)-N-[4-(phenylcarbamoylamino)phenyl]pyrrolidine-2-carboxamide Formula: C29H34N4O3 MolecularWeight: 486.60526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=CC=C(C=C5)NC(=O)NC6=CC=CC=C6

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NC5=CC=C(C=C5)NC(=O)NC6=CC=CC=C6

InChI

InChI=1S/C29H34N4O3/c34-26(30-23-8-10-24(11-9-23)32-28(36)31-22-5-2-1-3-6-22)25-7-4-12-33(25)27(35)29-16-19-13-20(17-29)15-21(14-19)18-29/h1-3,5-6,8-11,19-21,25H,4,7,12-18H2,(H,30,34)(H2,31,32,36)/t19?,20?,21?,25-,29?/m1/s1