2-[4-(2-bromanyl-4-methyl-phenyl)sulfonylpiperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(2-bromanyl-4-methyl-phenyl)sulfonylpiperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(2-bromo-4-methyl-phenyl)sulfonylpiperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-(2-bromo-4-methylphenyl)sulfonyl-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(2-bromo-4-methylphenyl)sulfonylpiperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(2-bromo-4-methyl-phenyl)sulfonylpiperazino]isonicotinonitrile Formula: C17H17BrN4O2S MolecularWeight: 421.31148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)Br

InChI

InChI=1S/C17H17BrN4O2S/c1-13-2-3-16(15(18)10-13)25(23,24)22-8-6-21(7-9-22)17-11-14(12-19)4-5-20-17/h2-5,10-11H,6-9H2,1H3