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

Systemtic Name: 1-[2-phenyl-6-[4-(phenylmethyl)piperazin-1-yl]-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone Openeye Name: 1-[6-(4-benzylpiperazin-1-yl)-2-phenyl-4-thioxo-1H-pyrimidin-5-yl]ethanone CAS Name: 1-[2-phenyl-6-[4-(phenylmethyl)-1-piperazinyl]-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone IUPAC Name: 1-[6-(4-benzylpiperazin-1-yl)-2-phenyl-4-sulfanylidene-1H-pyrimidin-5-yl]ethanone Traditional Name: 1-[6-(4-benzylpiperazino)-2-phenyl-4-thioxo-1H-pyrimidin-5-yl]ethanone Formula: C23H24N4OS MolecularWeight: 404.52786

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NC(=NC1=S)C2=CC=CC=C2)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C(NC(=NC1=S)C2=CC=CC=C2)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H24N4OS/c1-17(28)20-22(24-21(25-23(20)29)19-10-6-3-7-11-19)27-14-12-26(13-15-27)16-18-8-4-2-5-9-18/h2-11H,12-16H2,1H3,(H,24,25,29)