6-(4-bromophenyl)-2-butylsulfonyl-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-bromophenyl)-2-butylsulfonyl-4-phenyl-pyridine-3-carbonitrile Openeye Name: 6-(4-bromophenyl)-2-butylsulfonyl-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-(4-bromophenyl)-2-butylsulfonyl-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-(4-bromophenyl)-2-butylsulfonyl-4-phenylpyridine-3-carbonitrile Traditional Name: 6-(4-bromophenyl)-2-butylsulfonyl-4-phenyl-nicotinonitrile Formula: C22H19BrN2O2S MolecularWeight: 455.36746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=C(C(=CC(=N1)C2=CC=C(C=C2)Br)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCS(=O)(=O)C1=C(C(=CC(=N1)C2=CC=C(C=C2)Br)C3=CC=CC=C3)C#N

InChI

InChI=1S/C22H19BrN2O2S/c1-2-3-13-28(26,27)22-20(15-24)19(16-7-5-4-6-8-16)14-21(25-22)17-9-11-18(23)12-10-17/h4-12,14H,2-3,13H2,1H3