2,6-dimethyl-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]quinoline-4-carboxamide

Systemtic Name: 2,6-dimethyl-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]quinoline-4-carboxamide Openeye Name: 2,6-dimethyl-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydrobenzofuran-2-yl]methyl]quinoline-4-carboxamide CAS Name: 2,6-dimethyl-N-[[(2R)-7-(5-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-quinolinecarboxamide IUPAC Name: 2,6-dimethyl-N-[[(2R)-7-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]quinoline-4-carboxamide Traditional Name: 2,6-dimethyl-N-[[(2R)-7-(5-pyrimidyl)coumaran-2-yl]methyl]cinchoninamide Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3CC4=CC=CC(=C4O3)C5=CN=CN=C5)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC[C@H]3CC4=CC=CC(=C4O3)C5=CN=CN=C5)C

InChI

InChI=1S/C25H22N4O2/c1-15-6-7-23-21(8-15)22(9-16(2)29-23)25(30)28-13-19-10-17-4-3-5-20(24(17)31-19)18-11-26-14-27-12-18/h3-9,11-12,14,19H,10,13H2,1-2H3,(H,28,30)/t19-/m1/s1