(E)-2-(4-bromophenyl)sulfonyl-3-[[(2S)-butan-2-yl]amino]prop-2-enenitrile

Systemtic Name: (E)-2-(4-bromophenyl)sulfonyl-3-[[(2S)-butan-2-yl]amino]prop-2-enenitrile Openeye Name: (E)-2-(4-bromophenyl)sulfonyl-3-[[(1S)-1-methylpropyl]amino]prop-2-enenitrile CAS Name: (E)-2-(4-bromophenyl)sulfonyl-3-[[(2S)-butan-2-yl]amino]-2-propenenitrile IUPAC Name: (E)-2-(4-bromophenyl)sulfonyl-3-[[(2S)-butan-2-yl]amino]prop-2-enenitrile Traditional Name: (E)-2-brosyl-3-[[(1S)-1-methylpropyl]amino]acrylonitrile Formula: C13H15BrN2O2S MolecularWeight: 343.2394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC=C(C#N)S(=O)(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC[C@H](C)N/C=C(\C#N)/S(=O)(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C13H15BrN2O2S/c1-3-10(2)16-9-13(8-15)19(17,18)12-6-4-11(14)5-7-12/h4-7,9-10,16H,3H2,1-2H3/b13-9+/t10-/m0/s1