2-[5-(1H-benzimidazol-2-yl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridin-1-yl]-1,3-benzothiazole

Systemtic Name: 2-[5-(1H-benzimidazol-2-yl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridin-1-yl]-1,3-benzothiazole Openeye Name: 2-[5-(1H-benzimidazol-2-yl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridin-1-yl]-1,3-benzothiazole CAS Name: 2-[5-(1H-benzimidazol-2-yl)-3-methyl-6-phenyl-1-pyrazolo[3,4-b]pyridinyl]-1,3-benzothiazole IUPAC Name: 2-[5-(1H-benzimidazol-2-yl)-3-methyl-6-phenylpyrazolo[3,4-b]pyridin-1-yl]-1,3-benzothiazole Traditional Name: 2-[5-(1H-benzimidazol-2-yl)-3-methyl-6-phenyl-pyrazolo[3,4-b]pyridin-1-yl]-1,3-benzothiazole Formula: C27H18N6S MolecularWeight: 458.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC(=C(C=C12)C3=NC4=CC=CC=C4N3)C5=CC=CC=C5)C6=NC7=CC=CC=C7S6

Isomeric SMILES

CC1=NN(C2=NC(=C(C=C12)C3=NC4=CC=CC=C4N3)C5=CC=CC=C5)C6=NC7=CC=CC=C7S6

InChI

InChI=1S/C27H18N6S/c1-16-18-15-19(25-28-20-11-5-6-12-21(20)29-25)24(17-9-3-2-4-10-17)31-26(18)33(32-16)27-30-22-13-7-8-14-23(22)34-27/h2-15H,1H3,(H,28,29)