4-(4-butylsulfonylpiperazin-1-yl)-6-(3,5-dimethylpyrazol-1-yl)-2-methyl-pyrimidine

Systemtic Name: 4-(4-butylsulfonylpiperazin-1-yl)-6-(3,5-dimethylpyrazol-1-yl)-2-methyl-pyrimidine Openeye Name: 4-(4-butylsulfonylpiperazin-1-yl)-6-(3,5-dimethylpyrazol-1-yl)-2-methyl-pyrimidine CAS Name: 4-(4-butylsulfonyl-1-piperazinyl)-6-(3,5-dimethyl-1-pyrazolyl)-2-methylpyrimidine IUPAC Name: 4-(4-butylsulfonylpiperazin-1-yl)-6-(3,5-dimethylpyrazol-1-yl)-2-methylpyrimidine Traditional Name: 4-(4-butylsulfonylpiperazino)-6-(3,5-dimethylpyrazol-1-yl)-2-methyl-pyrimidine Formula: C18H28N6O2S MolecularWeight: 392.51892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2)N3C(=CC(=N3)C)C)C

Isomeric SMILES

CCCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2)N3C(=CC(=N3)C)C)C

InChI

InChI=1S/C18H28N6O2S/c1-5-6-11-27(25,26)23-9-7-22(8-10-23)17-13-18(20-16(4)19-17)24-15(3)12-14(2)21-24/h12-13H,5-11H2,1-4H3