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

Systemtic Name: 4-(aminomethyl)-N-methyl-N-[1-oxidanylidene-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pyrrolidine-2-carboxamide Openeye Name: 4-(aminomethyl)-N-methyl-N-[3-phenyl-1-(3-quinolylcarbamoyl)propyl]pyrrolidine-2-carboxamide CAS Name: 4-(aminomethyl)-N-methyl-N-[1-oxo-4-phenyl-1-(3-quinolinylamino)butan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 4-(aminomethyl)-N-methyl-N-[1-oxo-4-phenyl-1-(quinolin-3-ylamino)butan-2-yl]pyrrolidine-2-carboxamide Traditional Name: 4-(aminomethyl)-N-methyl-N-[3-phenyl-1-(3-quinolylcarbamoyl)propyl]pyrrolidine-2-carboxamide Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CCC1=CC=CC=C1)C(=O)NC2=CC3=CC=CC=C3N=C2)C(=O)C4CC(CN4)CN

Isomeric SMILES

CN(C(CCC1=CC=CC=C1)C(=O)NC2=CC3=CC=CC=C3N=C2)C(=O)C4CC(CN4)CN

InChI

InChI=1S/C26H31N5O2/c1-31(26(33)23-13-19(15-27)16-28-23)24(12-11-18-7-3-2-4-8-18)25(32)30-21-14-20-9-5-6-10-22(20)29-17-21/h2-10,14,17,19,23-24,28H,11-13,15-16,27H2,1H3,(H,30,32)