2-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]ethanenitrile

Systemtic Name: 2-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]ethanenitrile Openeye Name: 2-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]acetonitrile CAS Name: 2-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]acetonitrile IUPAC Name: 2-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]acetonitrile Traditional Name: 2-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]acetonitrile Formula: C12H9BrN2S MolecularWeight: 293.18226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)CC#N)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(N=C(S1)CC#N)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H9BrN2S/c1-8-12(15-11(16-8)6-7-14)9-2-4-10(13)5-3-9/h2-5H,6H2,1H3