5-[1-phenyl-2-(4-phenylpiperazin-1-yl)prop-2-enyl]-4-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-one

Systemtic Name: 5-[1-phenyl-2-(4-phenylpiperazin-1-yl)prop-2-enyl]-4-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-one Openeye Name: 5-[1-phenyl-2-(4-phenylpiperazin-1-yl)allyl]-4-thioxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-one CAS Name: 5-[1-phenyl-2-(4-phenyl-1-piperazinyl)prop-2-enyl]-4-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-one IUPAC Name: 5-[1-phenyl-2-(4-phenylpiperazin-1-yl)prop-2-enyl]-4-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-one Traditional Name: 5-[1-phenyl-2-(4-phenylpiperazino)allyl]-4-thioxo-1,2-dihydropyrazolo[3,4-d]pyrimidin-3-one Formula: C24H24N6OS MolecularWeight: 444.55196

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(C1=CC=CC=C1)N2C=NC3=C(C2=S)C(=O)NN3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C=C(C(C1=CC=CC=C1)N2C=NC3=C(C2=S)C(=O)NN3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C24H24N6OS/c1-17(28-12-14-29(15-13-28)19-10-6-3-7-11-19)21(18-8-4-2-5-9-18)30-16-25-22-20(24(30)32)23(31)27-26-22/h2-11,16,21H,1,12-15H2,(H2,26,27,31)