4-(4-bromophenyl)-5-methyl-2-sulfanyl-1H-pyrrole-3-carbonitrile

Systemtic Name: 4-(4-bromophenyl)-5-methyl-2-sulfanyl-1H-pyrrole-3-carbonitrile Openeye Name: 4-(4-bromophenyl)-5-methyl-2-sulfanyl-1H-pyrrole-3-carbonitrile CAS Name: 4-(4-bromophenyl)-2-mercapto-5-methyl-1H-pyrrole-3-carbonitrile IUPAC Name: 4-(4-bromophenyl)-5-methyl-2-sulfanyl-1H-pyrrole-3-carbonitrile Traditional Name: 4-(4-bromophenyl)-2-mercapto-5-methyl-1H-pyrrole-3-carbonitrile Formula: C12H9BrN2S MolecularWeight: 293.18226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)S)C#N)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C(=C(N1)S)C#N)C2=CC=C(C=C2)Br

InChI

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