4-(3-azanylpropyl)-N-[1-oxidanylidene-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 4-(3-azanylpropyl)-N-[1-oxidanylidene-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pyrrolidine-2-carboxamide Openeye Name: 4-(3-aminopropyl)-N-[3-phenyl-1-(3-quinolylcarbamoyl)propyl]pyrrolidine-2-carboxamide CAS Name: 4-(3-aminopropyl)-N-[1-oxo-4-phenyl-1-(3-quinolinylamino)butan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 4-(3-aminopropyl)-N-[1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pyrrolidine-2-carboxamide Traditional Name: 4-(3-aminopropyl)-N-[3-phenyl-1-(3-quinolylcarbamoyl)propyl]pyrrolidine-2-carboxamide Formula: C27H33N5O2 MolecularWeight: 459.58322

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C(=O)NC(CCC2=CC=CC=C2)C(=O)NC3=CC4=CC=CC=C4N=C3)CCCN

Isomeric SMILES

C1C(CNC1C(=O)NC(CCC2=CC=CC=C2)C(=O)NC3=CC4=CC=CC=C4N=C3)CCCN

InChI

InChI=1S/C27H33N5O2/c28-14-6-9-20-15-25(29-17-20)27(34)32-24(13-12-19-7-2-1-3-8-19)26(33)31-22-16-21-10-4-5-11-23(21)30-18-22/h1-5,7-8,10-11,16,18,20,24-25,29H,6,9,12-15,17,28H2,(H,31,33)(H,32,34)