2-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 2-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 2-[4-(4-tert-butyl-2,6-dimethylphenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(4-tert-butyl-2,6-dimethylphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 2-[4-(4-tert-butyl-2,6-dimethyl-phenyl)sulfonylpiperazino]pyrimidine Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3)C)C(C)(C)C

InChI

InChI=1S/C20H28N4O2S/c1-15-13-17(20(3,4)5)14-16(2)18(15)27(25,26)24-11-9-23(10-12-24)19-21-7-6-8-22-19/h6-8,13-14H,9-12H2,1-5H3