phenyl-[1-phenyl-4,6-bis(sulfanylidene)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]methanone

Systemtic Name: phenyl-[1-phenyl-4,6-bis(sulfanylidene)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]methanone Openeye Name: phenyl-(1-phenyl-4,6-dithioxo-2H-pyrazolo[3,4-d]pyrimidin-3-yl)methanone CAS Name: phenyl-[1-phenyl-4,6-bis(sulfanylidene)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]methanone IUPAC Name: phenyl-[1-phenyl-4,6-bis(sulfanylidene)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]methanone Traditional Name: phenyl-(1-phenyl-4,6-dithioxo-2H-pyrazolo[3,4-d]pyrimidin-3-yl)methanone Formula: C18H12N4OS2 MolecularWeight: 364.44408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C3C(=S)NC(=S)N=C3N(N2)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C3C(=S)NC(=S)N=C3N(N2)C4=CC=CC=C4

InChI

InChI=1S/C18H12N4OS2/c23-15(11-7-3-1-4-8-11)14-13-16(19-18(25)20-17(13)24)22(21-14)12-9-5-2-6-10-12/h1-10,21H,(H,20,24,25)