4-[4-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]-1-(triphenylmethyl)pyrazol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]-1-(triphenylmethyl)pyrazol-3-yl]benzenecarbonitrile Openeye Name: 4-[4-[4-(4-methylpiperazin-1-yl)-6-quinolyl]-1-trityl-pyrazol-3-yl]benzonitrile CAS Name: 4-[4-[4-(4-methyl-1-piperazinyl)-6-quinolinyl]-1-(triphenylmethyl)-3-pyrazolyl]benzonitrile IUPAC Name: 4-[4-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]-1-tritylpyrazol-3-yl]benzonitrile Traditional Name: 4-[4-[4-(4-methylpiperazino)-6-quinolyl]-1-trityl-pyrazol-3-yl]benzonitrile Formula: C43H36N6 MolecularWeight: 636.78614

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=C(C=CC3=NC=C2)C4=CN(N=C4C5=CC=C(C=C5)C#N)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

CN1CCN(CC1)C2=C3C=C(C=CC3=NC=C2)C4=CN(N=C4C5=CC=C(C=C5)C#N)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C43H36N6/c1-47-25-27-48(28-26-47)41-23-24-45-40-22-21-34(29-38(40)41)39-31-49(46-42(39)33-19-17-32(30-44)18-20-33)43(35-11-5-2-6-12-35,36-13-7-3-8-14-36)37-15-9-4-10-16-37/h2-24,29,31H,25-28H2,1H3