4-(aminomethyl)-N-[1-oxidanylidene-4-phenyl-1-(quinolin-6-ylamino)butan-2-yl]pyrrolidine-2-carboxamide

Systemtic Name: 4-(aminomethyl)-N-[1-oxidanylidene-4-phenyl-1-(quinolin-6-ylamino)butan-2-yl]pyrrolidine-2-carboxamide Openeye Name: 4-(aminomethyl)-N-[3-phenyl-1-(6-quinolylcarbamoyl)propyl]pyrrolidine-2-carboxamide CAS Name: 4-(aminomethyl)-N-[1-oxo-4-phenyl-1-(6-quinolinylamino)butan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 4-(aminomethyl)-N-[1-oxo-4-phenyl-1-(quinolin-6-ylamino)butan-2-yl]pyrrolidine-2-carboxamide Traditional Name: 4-(aminomethyl)-N-[3-phenyl-1-(6-quinolylcarbamoyl)propyl]pyrrolidine-2-carboxamide Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C(=O)NC(CCC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)N=CC=C4)CN

Isomeric SMILES

C1C(CNC1C(=O)NC(CCC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)N=CC=C4)CN

InChI

InChI=1S/C25H29N5O2/c26-15-18-13-23(28-16-18)25(32)30-22(10-8-17-5-2-1-3-6-17)24(31)29-20-9-11-21-19(14-20)7-4-12-27-21/h1-7,9,11-12,14,18,22-23,28H,8,10,13,15-16,26H2,(H,29,31)(H,30,32)