N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-quinoline-4-carboxamide Openeye Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-methyl-quinoline-4-carboxamide CAS Name: N-[[(2S)-5-(3,6-dimethyl-2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methylquinoline-4-carboxamide Traditional Name: N-[[(2S)-5-(3,6-dimethylpyrazin-2-yl)coumaran-2-yl]methyl]-2-methyl-cinchoninamide Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCC3CC4=C(O3)C=CC(=C4)C5=NC(=CN=C5C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)NC[C@@H]3CC4=C(O3)C=CC(=C4)C5=NC(=CN=C5C)C

InChI

InChI=1S/C26H24N4O2/c1-15-10-22(21-6-4-5-7-23(21)29-15)26(31)28-14-20-12-19-11-18(8-9-24(19)32-20)25-17(3)27-13-16(2)30-25/h4-11,13,20H,12,14H2,1-3H3,(H,28,31)/t20-/m0/s1