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

Systemtic Name: 4-[2-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[2-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[2-(1,3-benzothiazol-6-ylamino)-4-pyrimidinyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[2-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[2-(1,3-benzothiazol-6-ylamino)pyrimidin-4-yl]-N,N-dimethyl-benzenesulfonamide Formula: C19H17N5O2S2 MolecularWeight: 411.50058

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C19H17N5O2S2/c1-24(2)28(25,26)15-6-3-13(4-7-15)16-9-10-20-19(23-16)22-14-5-8-17-18(11-14)27-12-21-17/h3-12H,1-2H3,(H,20,22,23)