2-(4-bromophenyl)sulfonyl-3-[(2R)-butan-2-yl]imino-propanenitrile

Systemtic Name: 2-(4-bromophenyl)sulfonyl-3-[(2R)-butan-2-yl]imino-propanenitrile Openeye Name: 2-(4-bromophenyl)sulfonyl-3-[(1R)-1-methylpropyl]imino-propanenitrile CAS Name: 2-(4-bromophenyl)sulfonyl-3-[(2R)-butan-2-yl]iminopropanenitrile IUPAC Name: 2-(4-bromophenyl)sulfonyl-3-[(2R)-butan-2-yl]iminopropanenitrile Traditional Name: 2-brosyl-3-[(1R)-1-methylpropyl]imino-propionitrile Formula: C13H15BrN2O2S MolecularWeight: 343.2394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](C)N=CC(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/h4-7,9-10,13H,3H2,1-2H3/t10-,13?/m1/s1