3-methyl-N-[(4-methylphenyl)methyl]-N-[3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[(4-methylphenyl)methyl]-N-[3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]phenyl]butanamide Openeye Name: 3-methyl-N-[3-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]phenyl]-N-(p-tolylmethyl)butanamide CAS Name: 3-methyl-N-[(4-methylphenyl)methyl]-N-[3-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]phenyl]butanamide IUPAC Name: 3-methyl-N-[(4-methylphenyl)methyl]-N-[3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]phenyl]butanamide Traditional Name: N-[3-[2-keto-2-(4-methylpiperazino)ethyl]phenyl]-3-methyl-N-(4-methylbenzyl)butyramide Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC=CC(=C2)CC(=O)N3CCN(CC3)C)C(=O)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC=CC(=C2)CC(=O)N3CCN(CC3)C)C(=O)CC(C)C

InChI

InChI=1S/C26H35N3O2/c1-20(2)16-26(31)29(19-22-10-8-21(3)9-11-22)24-7-5-6-23(17-24)18-25(30)28-14-12-27(4)13-15-28/h5-11,17,20H,12-16,18-19H2,1-4H3