2-[4-[2,4-bis(methylsulfonyl)phenyl]piperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-[2,4-bis(methylsulfonyl)phenyl]piperazin-1-yl]pyrimidine Openeye Name: 2-[4-[2,4-bis(methylsulfonyl)phenyl]piperazin-1-yl]pyrimidine CAS Name: 2-[4-[2,4-bis(methylsulfonyl)phenyl]-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-[2,4-bis(methylsulfonyl)phenyl]piperazin-1-yl]pyrimidine Traditional Name: 2-[4-(2,4-dimesylphenyl)piperazino]pyrimidine Formula: C16H20N4O4S2 MolecularWeight: 396.4844

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=NC=CC=N3)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C3=NC=CC=N3)S(=O)(=O)C

InChI

InChI=1S/C16H20N4O4S2/c1-25(21,22)13-4-5-14(15(12-13)26(2,23)24)19-8-10-20(11-9-19)16-17-6-3-7-18-16/h3-7,12H,8-11H2,1-2H3