1-naphthalen-2-ylsulfonyl-N-[4-(pyridin-4-ylmethyl)phenyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-naphthalen-2-ylsulfonyl-N-[4-(pyridin-4-ylmethyl)phenyl]pyrrolidine-2-carboxamide Openeye Name: 1-(2-naphthylsulfonyl)-N-[4-(4-pyridylmethyl)phenyl]pyrrolidine-2-carboxamide CAS Name: 1-(2-naphthalenylsulfonyl)-N-[4-(pyridin-4-ylmethyl)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-naphthalen-2-ylsulfonyl-N-[4-(pyridin-4-ylmethyl)phenyl]pyrrolidine-2-carboxamide Traditional Name: 1-(2-naphthylsulfonyl)-N-[4-(4-pyridylmethyl)phenyl]pyrrolidine-2-carboxamide Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)NC4=CC=C(C=C4)CC5=CC=NC=C5

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)NC4=CC=C(C=C4)CC5=CC=NC=C5

InChI

InChI=1S/C27H25N3O3S/c31-27(29-24-10-7-20(8-11-24)18-21-13-15-28-16-14-21)26-6-3-17-30(26)34(32,33)25-12-9-22-4-1-2-5-23(22)19-25/h1-2,4-5,7-16,19,26H,3,6,17-18H2,(H,29,31)