N-(4-azanylbutyl)-1-[2-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylbutyl)-1-[2-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxamide Openeye Name: N-(4-aminobutyl)-1-[2-(2-naphthylsulfonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxamide CAS Name: N-(4-aminobutyl)-1-[2-(2-naphthalenylsulfonylamino)-1-oxo-3-phenylpropyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminobutyl)-1-[2-(naphthalen-2-ylsulfonylamino)-3-phenylpropanoyl]pyrrolidine-2-carboxamide Traditional Name: N-(4-aminobutyl)-1-[2-(2-naphthylsulfonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxamide Formula: C28H34N4O4S MolecularWeight: 522.65896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=O)NCCCCN

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=O)NCCCCN

InChI

InChI=1S/C28H34N4O4S/c29-16-6-7-17-30-27(33)26-13-8-18-32(26)28(34)25(19-21-9-2-1-3-10-21)31-37(35,36)24-15-14-22-11-4-5-12-23(22)20-24/h1-5,9-12,14-15,20,25-26,31H,6-8,13,16-19,29H2,(H,30,33)