2-[[2-(butylamino)pyrimidin-4-yl]amino]benzoic acid

Systemtic Name: 2-[[2-(butylamino)pyrimidin-4-yl]amino]benzoic acid Openeye Name: 2-[[2-(butylamino)pyrimidin-4-yl]amino]benzoic acid CAS Name: 2-[[2-(butylamino)-4-pyrimidinyl]amino]benzoic acid IUPAC Name: 2-[[2-(butylamino)pyrimidin-4-yl]amino]benzoic acid Traditional Name: 2-[[2-(butylamino)pyrimidin-4-yl]amino]benzoic acid Formula: C15H18N4O2 MolecularWeight: 286.32902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=CC(=N1)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCNC1=NC=CC(=N1)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H18N4O2/c1-2-3-9-16-15-17-10-8-13(19-15)18-12-7-5-4-6-11(12)14(20)21/h4-8,10H,2-3,9H2,1H3,(H,20,21)(H2,16,17,18,19)