5-bromanyl-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]pyrimidine

Systemtic Name: 5-bromanyl-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]pyrimidine Openeye Name: 5-bromo-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]pyrimidine CAS Name: 5-bromo-2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]pyrimidine IUPAC Name: 5-bromo-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]pyrimidine Traditional Name: 5-bromo-2-[4-(4-tert-butylphenyl)sulfonylpiperazino]pyrimidine Formula: C18H23BrN4O2S MolecularWeight: 439.36982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23BrN4O2S/c1-18(2,3)14-4-6-16(7-5-14)26(24,25)23-10-8-22(9-11-23)17-20-12-15(19)13-21-17/h4-7,12-13H,8-11H2,1-3H3