2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-5-thiophen-2-yl-1,3,4-oxadiazole

Systemtic Name: 2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-5-thiophen-2-yl-1,3,4-oxadiazole Openeye Name: 2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-5-(2-thienyl)-1,3,4-oxadiazole CAS Name: 2-[[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-5-thiophen-2-yl-1,3,4-oxadiazole IUPAC Name: 2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-5-thiophen-2-yl-1,3,4-oxadiazole Traditional Name: 2-[[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]-5-(2-thienyl)-1,3,4-oxadiazole Formula: C18H12N6OS2 MolecularWeight: 392.45748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=NN=C(O4)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=NN=C(O4)C5=CC=CS5

InChI

InChI=1S/C18H12N6OS2/c1-2-5-12(6-3-1)24-16-13(9-21-24)18(20-11-19-16)27-10-15-22-23-17(25-15)14-7-4-8-26-14/h1-9,11H,10H2