3-[[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[4-(3-keto-4H-1,4-benzoxazin-6-yl)pyrimidin-2-yl]amino]benzenesulfonamide Formula: C18H15N5O4S MolecularWeight: 397.4078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C18H15N5O4S/c19-28(25,26)13-3-1-2-12(9-13)21-18-20-7-6-14(23-18)11-4-5-16-15(8-11)22-17(24)10-27-16/h1-9H,10H2,(H,22,24)(H2,19,25,26)(H,20,21,23)