4-[[furan-2-ylmethyl-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[furan-2-ylmethyl-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-(2-furylmethyl)amino]methyl]-N-methyl-benzamide CAS Name: 4-[[2-furanylmethyl-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]amino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-(furan-2-ylmethyl)amino]methyl]-N-methylbenzamide Traditional Name: 4-[[[2-(4-benzylpiperazino)-2-keto-ethyl]-(2-furfuryl)amino]methyl]-N-methyl-benzamide Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)CC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(CC2=CC=CO2)CC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H32N4O3/c1-28-27(33)24-11-9-23(10-12-24)19-30(20-25-8-5-17-34-25)21-26(32)31-15-13-29(14-16-31)18-22-6-3-2-4-7-22/h2-12,17H,13-16,18-21H2,1H3,(H,28,33)