4-[(E)-[(5E)-4-methyl-3,6-bis(oxidanylidene)-5-(phenylmethylidene)piperazin-2-ylidene]methyl]-2-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]benzamide

Systemtic Name: 4-[(E)-[(5E)-4-methyl-3,6-bis(oxidanylidene)-5-(phenylmethylidene)piperazin-2-ylidene]methyl]-2-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]benzamide Openeye Name: 4-[(E)-[(5E)-5-benzylidene-4-methyl-3,6-dioxo-piperazin-2-ylidene]methyl]-2-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]benzamide CAS Name: 4-[(E)-[(5E)-4-methyl-3,6-dioxo-5-(phenylmethylene)-2-piperazinylidene]methyl]-2-[4-[(4-phenyl-1-piperazinyl)methyl]phenyl]benzamide IUPAC Name: 4-[(E)-[(5E)-5-benzylidene-4-methyl-3,6-dioxopiperazin-2-ylidene]methyl]-2-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]benzamide Traditional Name: 4-[(E)-[(5E)-5-benzal-3,6-diketo-4-methyl-piperazin-2-ylidene]methyl]-2-[4-[(4-phenylpiperazino)methyl]phenyl]benzamide Formula: C37H35N5O3 MolecularWeight: 597.7055

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=CC=CC=C2)C(=O)NC(=CC3=CC(=C(C=C3)C(=O)N)C4=CC=C(C=C4)CN5CCN(CC5)C6=CC=CC=C6)C1=O

Isomeric SMILES

CN1/C(=C/C2=CC=CC=C2)/C(=O)N/C(=C/C3=CC(=C(C=C3)C(=O)N)C4=CC=C(C=C4)CN5CCN(CC5)C6=CC=CC=C6)/C1=O

InChI

InChI=1S/C37H35N5O3/c1-40-34(24-26-8-4-2-5-9-26)36(44)39-33(37(40)45)23-28-14-17-31(35(38)43)32(22-28)29-15-12-27(13-16-29)25-41-18-20-42(21-19-41)30-10-6-3-7-11-30/h2-17,22-24H,18-21,25H2,1H3,(H2,38,43)(H,39,44)/b33-23+,34-24+