4-[(E)-2-(4-bromophenyl)sulfonyl-2-cyano-ethenyl]-1,5-dimethyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[(E)-2-(4-bromophenyl)sulfonyl-2-cyano-ethenyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-2-(4-bromophenyl)sulfonyl-2-cyano-vinyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-2-(4-bromophenyl)sulfonyl-2-cyanoethenyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-2-(4-bromophenyl)sulfonyl-2-cyanoethenyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-2-brosyl-2-cyano-vinyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C16H12BrN3O2S MolecularWeight: 390.25438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=C(\C#N)/S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H12BrN3O2S/c1-11-12(7-14(9-18)20(11)2)8-16(10-19)23(21,22)15-5-3-13(17)4-6-15/h3-8H,1-2H3/b16-8+