2-[4-(5-bromanyl-2-ethoxy-phenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-(5-bromanyl-2-ethoxy-phenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 2-[4-(5-bromo-2-ethoxy-phenyl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 2-[4-(5-bromo-2-ethoxyphenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-(5-bromo-2-ethoxyphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 2-[4-(5-bromo-2-ethoxy-phenyl)sulfonylpiperazino]pyrimidine Formula: C16H19BrN4O3S MolecularWeight: 427.31606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H19BrN4O3S/c1-2-24-14-5-4-13(17)12-15(14)25(22,23)21-10-8-20(9-11-21)16-18-6-3-7-19-16/h3-7,12H,2,8-11H2,1H3