2-[4-(3-methoxyphenyl)piperazin-1-yl]-4,6-dimethyl-pyrimidine; sulfuric acid

Systemtic Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-4,6-dimethyl-pyrimidine; sulfuric acid Openeye Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-4,6-dimethyl-pyrimidine; sulfuric acid CAS Name: 2-[4-(3-methoxyphenyl)-1-piperazinyl]-4,6-dimethylpyrimidine; sulfuric acid IUPAC Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]-4,6-dimethylpyrimidine; sulfuric acid Traditional Name: 2-[4-(3-methoxyphenyl)piperazino]-4,6-dimethyl-pyrimidine; sulfuric acid Formula: C17H24N4O5S MolecularWeight: 396.46126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O.H2O4S/c1-13-11-14(2)19-17(18-13)21-9-7-20(8-10-21)15-5-4-6-16(12-15)22-3;1-5(2,3)4/h4-6,11-12H,7-10H2,1-3H3;(H2,1,2,3,4)