4-[[4-(3-pyrimidin-4-yl-2,1-benzoxazol-5-yl)pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[4-(3-pyrimidin-4-yl-2,1-benzoxazol-5-yl)pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[4-(3-pyrimidin-4-yl-2,1-benzoxazol-5-yl)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[4-[3-(4-pyrimidinyl)-2,1-benzoxazol-5-yl]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 4-[[4-(3-pyrimidin-4-yl-2,1-benzoxazol-5-yl)pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[4-[3-(4-pyrimidyl)anthranil-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C21H15N7O3S MolecularWeight: 445.4539

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC=CC(=N2)C3=CC4=C(ON=C4C=C3)C5=NC=NC=C5)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC2=NC=CC(=N2)C3=CC4=C(ON=C4C=C3)C5=NC=NC=C5)S(=O)(=O)N

InChI

InChI=1S/C21H15N7O3S/c22-32(29,30)15-4-2-14(3-5-15)26-21-24-10-8-17(27-21)13-1-6-18-16(11-13)20(31-28-18)19-7-9-23-12-25-19/h1-12H,(H2,22,29,30)(H,24,26,27)