N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-methyl-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-methyl-N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-N-methyl-2-(3-pyridyl)cinchoninamide Formula: C22H19N5O3 MolecularWeight: 401.41796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN(C)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN(C)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C22H19N5O3/c1-14-10-20(26-30-14)25-21(28)13-27(2)22(29)17-11-19(15-6-5-9-23-12-15)24-18-8-4-3-7-16(17)18/h3-12H,13H2,1-2H3,(H,25,26,28)