4,5-diphenyl-2-[[3-[4-(phenylmethyl)piperazin-1-yl]quinoxalin-2-yl]amino]furan-3-carbonitrile

Systemtic Name: 4,5-diphenyl-2-[[3-[4-(phenylmethyl)piperazin-1-yl]quinoxalin-2-yl]amino]furan-3-carbonitrile Openeye Name: 2-[[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl]amino]-4,5-diphenyl-furan-3-carbonitrile CAS Name: 4,5-diphenyl-2-[[3-[4-(phenylmethyl)-1-piperazinyl]-2-quinoxalinyl]amino]-3-furancarbonitrile IUPAC Name: 2-[[3-(4-benzylpiperazin-1-yl)quinoxalin-2-yl]amino]-4,5-diphenylfuran-3-carbonitrile Traditional Name: 2-[[3-(4-benzylpiperazino)quinoxalin-2-yl]amino]-4,5-diphenyl-3-furonitrile Formula: C36H30N6O MolecularWeight: 562.663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC4=CC=CC=C4N=C3NC5=C(C(=C(O5)C6=CC=CC=C6)C7=CC=CC=C7)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC4=CC=CC=C4N=C3NC5=C(C(=C(O5)C6=CC=CC=C6)C7=CC=CC=C7)C#N

InChI

InChI=1S/C36H30N6O/c37-24-29-32(27-14-6-2-7-15-27)33(28-16-8-3-9-17-28)43-36(29)40-34-35(39-31-19-11-10-18-30(31)38-34)42-22-20-41(21-23-42)25-26-12-4-1-5-13-26/h1-19H,20-23,25H2,(H,38,40)