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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=NC(=NO4)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=NC(=NO4)C5=CC=CS5

InChI

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