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

Systemtic Name: 4,5-diphenyl-2-[[3-[4-(phenylmethyl)piperidin-1-yl]quinoxalin-2-yl]amino]furan-3-carbonitrile Openeye Name: 2-[[3-(4-benzyl-1-piperidyl)quinoxalin-2-yl]amino]-4,5-diphenyl-furan-3-carbonitrile CAS Name: 4,5-diphenyl-2-[[3-[4-(phenylmethyl)-1-piperidinyl]-2-quinoxalinyl]amino]-3-furancarbonitrile IUPAC Name: 2-[[3-(4-benzylpiperidin-1-yl)quinoxalin-2-yl]amino]-4,5-diphenylfuran-3-carbonitrile Traditional Name: 2-[[3-(4-benzylpiperidino)quinoxalin-2-yl]amino]-4,5-diphenyl-3-furonitrile Formula: C37H31N5O MolecularWeight: 561.67494

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=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(CCC1CC2=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/C37H31N5O/c38-25-30-33(28-14-6-2-7-15-28)34(29-16-8-3-9-17-29)43-37(30)41-35-36(40-32-19-11-10-18-31(32)39-35)42-22-20-27(21-23-42)24-26-12-4-1-5-13-26/h1-19,27H,20-24H2,(H,39,41)