4-[[5-[(E)-2-(2-azanyl-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]-N-piperidin-3-yl-benzenesulfonamide

Systemtic Name: 4-[[5-[(E)-2-(2-azanyl-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]-N-piperidin-3-yl-benzenesulfonamide Openeye Name: 4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)vinyl]pyrimidin-2-yl]amino]-N-(3-piperidyl)benzenesulfonamide CAS Name: 4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]-2-pyrimidinyl]amino]-N-(3-piperidinyl)benzenesulfonamide IUPAC Name: 4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]amino]-N-piperidin-3-ylbenzenesulfonamide Traditional Name: 4-[[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)vinyl]pyrimidin-2-yl]amino]-N-(3-piperidyl)benzenesulfonamide Formula: C24H25N7O2S2 MolecularWeight: 507.631

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)NS(=O)(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)C=CC4=CC5=C(C=C4)N=C(S5)N

Isomeric SMILES

C1CC(CNC1)NS(=O)(=O)C2=CC=C(C=C2)NC3=NC=C(C=N3)/C=C/C4=CC5=C(C=C4)N=C(S5)N

InChI

InChI=1S/C24H25N7O2S2/c25-23-30-21-10-5-16(12-22(21)34-23)3-4-17-13-27-24(28-14-17)29-18-6-8-20(9-7-18)35(32,33)31-19-2-1-11-26-15-19/h3-10,12-14,19,26,31H,1-2,11,15H2,(H2,25,30)(H,27,28,29)/b4-3+