5-(4-bromophenyl)sulfonyl-2-phenyl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(4-bromophenyl)sulfonyl-2-phenyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-(4-bromophenyl)sulfonyl-2-phenyl-oxazole-4-carbonitrile CAS Name: 5-(4-bromophenyl)sulfonyl-2-phenyl-4-oxazolecarbonitrile IUPAC Name: 5-(4-bromophenyl)sulfonyl-2-phenyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-brosyl-2-phenyl-oxazole-4-carbonitrile Formula: C16H9BrN2O3S MolecularWeight: 389.22326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(O2)S(=O)(=O)C3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(O2)S(=O)(=O)C3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C16H9BrN2O3S/c17-12-6-8-13(9-7-12)23(20,21)16-14(10-18)19-15(22-16)11-4-2-1-3-5-11/h1-9H