4-[carbamimidoyl-(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid

Systemtic Name: 4-[carbamimidoyl-(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid Openeye Name: 4-[carbamimidoyl-(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid CAS Name: 4-[carbamimidoyl-(4,6-dimethyl-2-pyrimidinyl)amino]benzoic acid IUPAC Name: 4-[carbamimidoyl-(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid Traditional Name: 4-[amidino-(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid Formula: C14H15N5O2 MolecularWeight: 285.3012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N(C2=CC=C(C=C2)C(=O)O)C(=N)N)C

Isomeric SMILES

CC1=CC(=NC(=N1)N(C2=CC=C(C=C2)C(=O)O)C(=N)N)C

InChI

InChI=1S/C14H15N5O2/c1-8-7-9(2)18-14(17-8)19(13(15)16)11-5-3-10(4-6-11)12(20)21/h3-7H,1-2H3,(H3,15,16)(H,20,21)