3-[[4-(quinolin-5-ylamino)pyrimidin-2-yl]amino]benzamide

Systemtic Name: 3-[[4-(quinolin-5-ylamino)pyrimidin-2-yl]amino]benzamide Openeye Name: 3-[[4-(5-quinolylamino)pyrimidin-2-yl]amino]benzamide CAS Name: 3-[[4-(5-quinolinylamino)-2-pyrimidinyl]amino]benzamide IUPAC Name: 3-[[4-(quinolin-5-ylamino)pyrimidin-2-yl]amino]benzamide Traditional Name: 3-[[4-(5-quinolylamino)pyrimidin-2-yl]amino]benzamide Formula: C20H16N6O MolecularWeight: 356.38064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=CC(=N2)NC3=CC=CC4=C3C=CC=N4)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=CC(=N2)NC3=CC=CC4=C3C=CC=N4)C(=O)N

InChI

InChI=1S/C20H16N6O/c21-19(27)13-4-1-5-14(12-13)24-20-23-11-9-18(26-20)25-17-8-2-7-16-15(17)6-3-10-22-16/h1-12H,(H2,21,27)(H2,23,24,25,26)