N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-2-(1-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-2-(1-methylpyrazol-4-yl)cinchoninamide Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)N(C)CC4COCCO4

Isomeric SMILES

CN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)N(C)C[C@H]4COCCO4

InChI

InChI=1S/C20H22N4O3/c1-23(12-15-13-26-7-8-27-15)20(25)17-9-19(14-10-21-24(2)11-14)22-18-6-4-3-5-16(17)18/h3-6,9-11,15H,7-8,12-13H2,1-2H3/t15-/m0/s1