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

Systemtic Name: 5-(4-bromophenyl)sulfonyl-2-ethyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-(4-bromophenyl)sulfonyl-2-ethyl-oxazole-4-carbonitrile CAS Name: 5-(4-bromophenyl)sulfonyl-2-ethyl-4-oxazolecarbonitrile IUPAC Name: 5-(4-bromophenyl)sulfonyl-2-ethyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-brosyl-2-ethyl-oxazole-4-carbonitrile Formula: C12H9BrN2O3S MolecularWeight: 341.18046

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(O1)S(=O)(=O)C2=CC=C(C=C2)Br)C#N

Isomeric SMILES

CCC1=NC(=C(O1)S(=O)(=O)C2=CC=C(C=C2)Br)C#N

InChI

InChI=1S/C12H9BrN2O3S/c1-2-11-15-10(7-14)12(18-11)19(16,17)9-5-3-8(13)4-6-9/h3-6H,2H2,1H3