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

Systemtic Name: 3-[[5-chloranyl-4-[(3-oxidanylidene-4-propyl-1,4-benzothiazin-6-yl)amino]pyrimidin-2-yl]amino]-N-methyl-benzenesulfonamide Openeye Name: 3-[[5-chloro-4-[(3-oxo-4-propyl-1,4-benzothiazin-6-yl)amino]pyrimidin-2-yl]amino]-N-methyl-benzenesulfonamide CAS Name: 3-[[5-chloro-4-[(3-oxo-4-propyl-1,4-benzothiazin-6-yl)amino]-2-pyrimidinyl]amino]-N-methylbenzenesulfonamide IUPAC Name: 3-[[5-chloro-4-[(3-oxo-4-propyl-1,4-benzothiazin-6-yl)amino]pyrimidin-2-yl]amino]-N-methylbenzenesulfonamide Traditional Name: 3-[[5-chloro-4-[(3-keto-4-propyl-1,4-benzothiazin-6-yl)amino]pyrimidin-2-yl]amino]-N-methyl-benzenesulfonamide Formula: C22H23ClN6O3S2 MolecularWeight: 519.03942

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)CSC2=C1C=C(C=C2)NC3=NC(=NC=C3Cl)NC4=CC(=CC=C4)S(=O)(=O)NC

Isomeric SMILES

CCCN1C(=O)CSC2=C1C=C(C=C2)NC3=NC(=NC=C3Cl)NC4=CC(=CC=C4)S(=O)(=O)NC

InChI

InChI=1S/C22H23ClN6O3S2/c1-3-9-29-18-11-15(7-8-19(18)33-13-20(29)30)26-21-17(23)12-25-22(28-21)27-14-5-4-6-16(10-14)34(31,32)24-2/h4-8,10-12,24H,3,9,13H2,1-2H3,(H2,25,26,27,28)