(E)-2-(4-bromophenyl)sulfonyl-3-(4-pyrrolidin-1-ylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-pyrrolidin-1-ylphenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-pyrrolidin-1-ylphenyl)prop-2-enenitrile CAS Name: (E)-2-(4-bromophenyl)sulfonyl-3-[4-(1-pyrrolidinyl)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(4-bromophenyl)sulfonyl-3-(4-pyrrolidin-1-ylphenyl)prop-2-enenitrile Traditional Name: (E)-2-brosyl-3-(4-pyrrolidinophenyl)acrylonitrile Formula: C19H17BrN2O2S MolecularWeight: 417.31948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)/C=C(\C#N)/S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN2O2S/c20-16-5-9-18(10-6-16)25(23,24)19(14-21)13-15-3-7-17(8-4-15)22-11-1-2-12-22/h3-10,13H,1-2,11-12H2/b19-13+