8-[(2-azanyl-1,3-benzothiazol-6-yl)methylcarbamoyl]-2-pyridin-4-yl-imidazo[1,2-a]pyridine-3-carboxylic acid

Systemtic Name: 8-[(2-azanyl-1,3-benzothiazol-6-yl)methylcarbamoyl]-2-pyridin-4-yl-imidazo[1,2-a]pyridine-3-carboxylic acid Openeye Name: 8-[(2-amino-1,3-benzothiazol-6-yl)methylcarbamoyl]-2-(4-pyridyl)imidazo[1,2-a]pyridine-3-carboxylic acid CAS Name: 8-[[(2-amino-1,3-benzothiazol-6-yl)methylamino]-oxomethyl]-2-pyridin-4-yl-3-imidazo[1,2-a]pyridinecarboxylic acid IUPAC Name: 8-[(2-amino-1,3-benzothiazol-6-yl)methylcarbamoyl]-2-pyridin-4-ylimidazo[1,2-a]pyridine-3-carboxylic acid Traditional Name: 8-[(2-amino-1,3-benzothiazol-6-yl)methylcarbamoyl]-2-(4-pyridyl)imidazo[1,2-a]pyridine-3-carboxylic acid Formula: C22H16N6O3S MolecularWeight: 444.46584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN2C(=C(N=C2C(=C1)C(=O)NCC3=CC4=C(C=C3)N=C(S4)N)C5=CC=NC=C5)C(=O)O

Isomeric SMILES

C1=CN2C(=C(N=C2C(=C1)C(=O)NCC3=CC4=C(C=C3)N=C(S4)N)C5=CC=NC=C5)C(=O)O

InChI

InChI=1S/C22H16N6O3S/c23-22-26-15-4-3-12(10-16(15)32-22)11-25-20(29)14-2-1-9-28-18(21(30)31)17(27-19(14)28)13-5-7-24-8-6-13/h1-10H,11H2,(H2,23,26)(H,25,29)(H,30,31)