4,6-dimethyl-2-[4-(phenylmethyl)piperazin-1-yl]pyrimidine; sulfuric acid

Systemtic Name: 4,6-dimethyl-2-[4-(phenylmethyl)piperazin-1-yl]pyrimidine; sulfuric acid Openeye Name: 2-(4-benzylpiperazin-1-yl)-4,6-dimethyl-pyrimidine; sulfuric acid CAS Name: 4,6-dimethyl-2-[4-(phenylmethyl)-1-piperazinyl]pyrimidine; sulfuric acid IUPAC Name: 2-(4-benzylpiperazin-1-yl)-4,6-dimethylpyrimidine; sulfuric acid Traditional Name: 2-(4-benzylpiperazino)-4,6-dimethyl-pyrimidine; sulfuric acid Formula: C17H24N4O4S MolecularWeight: 380.46186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)CC3=CC=CC=C3)C.OS(=O)(=O)O

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)CC3=CC=CC=C3)C.OS(=O)(=O)O

InChI

InChI=1S/C17H22N4.H2O4S/c1-14-12-15(2)19-17(18-14)21-10-8-20(9-11-21)13-16-6-4-3-5-7-16;1-5(2,3)4/h3-7,12H,8-11,13H2,1-2H3;(H2,1,2,3,4)