N-[4-[2-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-[2-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[2-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[2-(1,3-benzothiazol-6-ylamino)-4-pyrimidinyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[2-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[2-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]phenyl]-4-methyl-benzenesulfonamide Formula: C24H19N5O2S2 MolecularWeight: 473.56996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C24H19N5O2S2/c1-16-2-9-20(10-3-16)33(30,31)29-18-6-4-17(5-7-18)21-12-13-25-24(28-21)27-19-8-11-22-23(14-19)32-15-26-22/h2-15,29H,1H3,(H,25,27,28)