4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonyl-2-methyl-1-(3-methylphenyl)piperazine

Systemtic Name: 4-(5-bromanyl-6-chloranyl-pyridin-3-yl)sulfonyl-2-methyl-1-(3-methylphenyl)piperazine Openeye Name: 4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]-2-methyl-1-(m-tolyl)piperazine CAS Name: 4-[(5-bromo-6-chloro-3-pyridinyl)sulfonyl]-2-methyl-1-(3-methylphenyl)piperazine IUPAC Name: 4-(5-bromo-6-chloropyridin-3-yl)sulfonyl-2-methyl-1-(3-methylphenyl)piperazine Traditional Name: 4-[(5-bromo-6-chloro-3-pyridyl)sulfonyl]-2-methyl-1-(m-tolyl)piperazine Formula: C17H19BrClN3O2S MolecularWeight: 444.77366

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC(=C(N=C3)Cl)Br

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC(=C(N=C3)Cl)Br

InChI

InChI=1S/C17H19BrClN3O2S/c1-12-4-3-5-14(8-12)22-7-6-21(11-13(22)2)25(23,24)15-9-16(18)17(19)20-10-15/h3-5,8-10,13H,6-7,11H2,1-2H3