4-tert-butyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]-N-pyridin-2-yl-benzamide trichloride

Systemtic Name: 4-tert-butyl-N-[1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]-N-pyridin-2-yl-benzamide trichloride Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-ethyl]-4-tert-butyl-N-(2-pyridyl)benzamide trichloride CAS Name: 4-tert-butyl-N-[1-[4-(phenylmethyl)-1-piperazinyl]propan-2-yl]-N-(2-pyridinyl)benzamide trichloride IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)propan-2-yl]-4-tert-butyl-N-pyridin-2-ylbenzamide trichloride Traditional Name: N-[2-(4-benzylpiperazino)-1-methyl-ethyl]-4-tert-butyl-N-(2-pyridyl)benzamide trichloride Formula: C30H38Cl3N4O-3 MolecularWeight: 577.00792

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)CC2=CC=CC=C2)N(C3=CC=CC=N3)C(=O)C4=CC=C(C=C4)C(C)(C)C.[Cl-].[Cl-].[Cl-]

Isomeric SMILES

CC(CN1CCN(CC1)CC2=CC=CC=C2)N(C3=CC=CC=N3)C(=O)C4=CC=C(C=C4)C(C)(C)C.[Cl-].[Cl-].[Cl-]

InChI

InChI=1S/C30H38N4O.3ClH/c1-24(22-32-18-20-33(21-19-32)23-25-10-6-5-7-11-25)34(28-12-8-9-17-31-28)29(35)26-13-15-27(16-14-26)30(2,3)4;;;/h5-17,24H,18-23H2,1-4H3;3*1H/p-3