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

Systemtic Name: 2-[1-(3-chlorophenyl)-3-methyl-6-phenyl-4-pyridin-3-yl-pyrazolo[3,4-b]pyridin-5-yl]-1,3-benzothiazole Openeye Name: 2-[1-(3-chlorophenyl)-3-methyl-6-phenyl-4-(3-pyridyl)pyrazolo[3,4-b]pyridin-5-yl]-1,3-benzothiazole CAS Name: 2-[1-(3-chlorophenyl)-3-methyl-6-phenyl-4-(3-pyridinyl)-5-pyrazolo[3,4-b]pyridinyl]-1,3-benzothiazole IUPAC Name: 2-[1-(3-chlorophenyl)-3-methyl-6-phenyl-4-pyridin-3-ylpyrazolo[3,4-b]pyridin-5-yl]-1,3-benzothiazole Traditional Name: 2-[1-(3-chlorophenyl)-3-methyl-6-phenyl-4-(3-pyridyl)pyrazolo[3,4-b]pyridin-5-yl]-1,3-benzothiazole Formula: C31H20ClN5S MolecularWeight: 530.042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC(=C(C(=C12)C3=CN=CC=C3)C4=NC5=CC=CC=C5S4)C6=CC=CC=C6)C7=CC(=CC=C7)Cl

Isomeric SMILES

CC1=NN(C2=NC(=C(C(=C12)C3=CN=CC=C3)C4=NC5=CC=CC=C5S4)C6=CC=CC=C6)C7=CC(=CC=C7)Cl

InChI

InChI=1S/C31H20ClN5S/c1-19-26-27(21-11-8-16-33-18-21)28(31-34-24-14-5-6-15-25(24)38-31)29(20-9-3-2-4-10-20)35-30(26)37(36-19)23-13-7-12-22(32)17-23/h2-18H,1H3