N-[(2R)-1-(dimethylamino)propan-2-yl]-2-(2-ethylpyrimidin-5-yl)-8-methyl-quinoline-4-carboxamide

Systemtic Name: N-[(2R)-1-(dimethylamino)propan-2-yl]-2-(2-ethylpyrimidin-5-yl)-8-methyl-quinoline-4-carboxamide Openeye Name: N-[(1R)-2-(dimethylamino)-1-methyl-ethyl]-2-(2-ethylpyrimidin-5-yl)-8-methyl-quinoline-4-carboxamide CAS Name: N-[(2R)-1-(dimethylamino)propan-2-yl]-2-(2-ethyl-5-pyrimidinyl)-8-methyl-4-quinolinecarboxamide IUPAC Name: N-[(2R)-1-(dimethylamino)propan-2-yl]-2-(2-ethylpyrimidin-5-yl)-8-methylquinoline-4-carboxamide Traditional Name: N-[(1R)-2-(dimethylamino)-1-methyl-ethyl]-2-(2-ethylpyrimidin-5-yl)-8-methyl-cinchoninamide Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C=N1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)NC(C)CN(C)C

Isomeric SMILES

CCC1=NC=C(C=N1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)N[C@H](C)CN(C)C

InChI

InChI=1S/C22H27N5O/c1-6-20-23-11-16(12-24-20)19-10-18(22(28)25-15(3)13-27(4)5)17-9-7-8-14(2)21(17)26-19/h7-12,15H,6,13H2,1-5H3,(H,25,28)/t15-/m1/s1