2-[4-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 2-[4-(4-bromo-2-ethyl-phenyl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 2-[4-(4-bromo-2-ethylphenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(4-bromo-2-ethylphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 2-[4-(4-bromo-2-ethyl-phenyl)sulfonylpiperazino]pyrimidine Formula: C16H19BrN4O2S MolecularWeight: 411.31666

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H19BrN4O2S/c1-2-13-12-14(17)4-5-15(13)24(22,23)21-10-8-20(9-11-21)16-18-6-3-7-19-16/h3-7,12H,2,8-11H2,1H3