3-[[5-chloranyl-4-[(4-ethyl-3-oxidanylidene-1,4-benzoxazin-6-yl)amino]pyrimidin-2-yl]amino]-N-methyl-benzenesulfonamide

Systemtic Name: 3-[[5-chloranyl-4-[(4-ethyl-3-oxidanylidene-1,4-benzoxazin-6-yl)amino]pyrimidin-2-yl]amino]-N-methyl-benzenesulfonamide Openeye Name: 3-[[5-chloro-4-[(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)amino]pyrimidin-2-yl]amino]-N-methyl-benzenesulfonamide CAS Name: 3-[[5-chloro-4-[(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)amino]-2-pyrimidinyl]amino]-N-methylbenzenesulfonamide IUPAC Name: 3-[[5-chloro-4-[(4-ethyl-3-oxo-1,4-benzoxazin-6-yl)amino]pyrimidin-2-yl]amino]-N-methylbenzenesulfonamide Traditional Name: 3-[[5-chloro-4-[(4-ethyl-3-keto-1,4-benzoxazin-6-yl)amino]pyrimidin-2-yl]amino]-N-methyl-benzenesulfonamide Formula: C21H21ClN6O4S MolecularWeight: 488.94724

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)COC2=C1C=C(C=C2)NC3=NC(=NC=C3Cl)NC4=CC(=CC=C4)S(=O)(=O)NC

Isomeric SMILES

CCN1C(=O)COC2=C1C=C(C=C2)NC3=NC(=NC=C3Cl)NC4=CC(=CC=C4)S(=O)(=O)NC

InChI

InChI=1S/C21H21ClN6O4S/c1-3-28-17-10-14(7-8-18(17)32-12-19(28)29)25-20-16(22)11-24-21(27-20)26-13-5-4-6-15(9-13)33(30,31)23-2/h4-11,23H,3,12H2,1-2H3,(H2,24,25,26,27)