1-[2-phenyl-6-(4-phenylpiperazin-1-yl)-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[2-phenyl-6-(4-phenylpiperazin-1-yl)-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone Openeye Name: 1-[2-phenyl-6-(4-phenylpiperazin-1-yl)-4-thioxo-1H-pyrimidin-5-yl]ethanone CAS Name: 1-[2-phenyl-6-(4-phenyl-1-piperazinyl)-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone IUPAC Name: 1-[2-phenyl-6-(4-phenylpiperazin-1-yl)-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone Traditional Name: 1-[2-phenyl-6-(4-phenylpiperazino)-4-thioxo-1H-pyrimidin-5-yl]ethanone Formula: C22H22N4OS MolecularWeight: 390.50128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NC(=NC1=S)C2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C(NC(=NC1=S)C2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4OS/c1-16(27)19-21(23-20(24-22(19)28)17-8-4-2-5-9-17)26-14-12-25(13-15-26)18-10-6-3-7-11-18/h2-11H,12-15H2,1H3,(H,23,24,28)