(2S)-N-[3-(dimethylamino)propyl]-N-methyl-1-(4-phenylazanylpyrimidin-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[3-(dimethylamino)propyl]-N-methyl-1-(4-phenylazanylpyrimidin-2-yl)pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-[3-(dimethylamino)propyl]-N-methyl-pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-anilino-2-pyrimidinyl)-N-[3-(dimethylamino)propyl]-N-methyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-[3-(dimethylamino)propyl]-N-methylpyrrolidine-2-carboxamide Traditional Name: (2S)-1-(4-anilinopyrimidin-2-yl)-N-[3-(dimethylamino)propyl]-N-methyl-pyrrolidine-2-carboxamide Formula: C21H30N6O MolecularWeight: 382.5025

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(C)C(=O)C1CCCN1C2=NC=CC(=N2)NC3=CC=CC=C3

Isomeric SMILES

CN(C)CCCN(C)C(=O)[C@@H]1CCCN1C2=NC=CC(=N2)NC3=CC=CC=C3

InChI

InChI=1S/C21H30N6O/c1-25(2)14-8-15-26(3)20(28)18-11-7-16-27(18)21-22-13-12-19(24-21)23-17-9-5-4-6-10-17/h4-6,9-10,12-13,18H,7-8,11,14-16H2,1-3H3,(H,22,23,24)/t18-/m0/s1