3-[[4-(diethylcarbamoyl)phenyl]-[4-(phenylmethyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: 3-[[4-(diethylcarbamoyl)phenyl]-[4-(phenylmethyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[(4-benzylpiperazin-1-yl)-[4-(diethylcarbamoyl)phenyl]methyl]benzamide CAS Name: 3-[[4-[diethylamino(oxo)methyl]phenyl]-[4-(phenylmethyl)-1-piperazinyl]methyl]benzamide IUPAC Name: 3-[(4-benzylpiperazin-1-yl)-[4-(diethylcarbamoyl)phenyl]methyl]benzamide Traditional Name: 3-[(4-benzylpiperazino)-[4-(diethylcarbamoyl)phenyl]methyl]benzamide Formula: C30H36N4O2 MolecularWeight: 484.63244

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC(=C2)C(=O)N)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC(=C2)C(=O)N)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C30H36N4O2/c1-3-33(4-2)30(36)25-15-13-24(14-16-25)28(26-11-8-12-27(21-26)29(31)35)34-19-17-32(18-20-34)22-23-9-6-5-7-10-23/h5-16,21,28H,3-4,17-20,22H2,1-2H3,(H2,31,35)