2-(5-bromanyl-2-methoxy-phenyl)-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1,3-thiazole

Systemtic Name: 2-(5-bromanyl-2-methoxy-phenyl)-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1,3-thiazole Openeye Name: 2-(5-bromo-2-methoxy-phenyl)-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]thiazole CAS Name: 2-(5-bromo-2-methoxyphenyl)-4-[[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]thiazole IUPAC Name: 2-(5-bromo-2-methoxyphenyl)-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1,3-thiazole Traditional Name: 2-(5-bromo-2-methoxy-phenyl)-4-[[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]thiazole Formula: C22H16BrN5OS2 MolecularWeight: 510.42934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C22H16BrN5OS2/c1-29-19-8-7-14(23)9-17(19)22-27-15(12-31-22)11-30-21-18-10-26-28(20(18)24-13-25-21)16-5-3-2-4-6-16/h2-10,12-13H,11H2,1H3