2-azanyl-1-[2,4-bis(bromanyl)-6-methylsulfanyl-phenyl]-4-methyl-pyrrole-3-carbonitrile

Systemtic Name: 2-azanyl-1-[2,4-bis(bromanyl)-6-methylsulfanyl-phenyl]-4-methyl-pyrrole-3-carbonitrile Openeye Name: 2-amino-1-(2,4-dibromo-6-methylsulfanyl-phenyl)-4-methyl-pyrrole-3-carbonitrile CAS Name: 2-amino-1-[2,4-dibromo-6-(methylthio)phenyl]-4-methyl-3-pyrrolecarbonitrile IUPAC Name: 2-amino-1-(2,4-dibromo-6-methylsulfanylphenyl)-4-methylpyrrole-3-carbonitrile Traditional Name: 2-amino-1-[2,4-dibromo-6-(methylthio)phenyl]-4-methyl-pyrrole-3-carbonitrile Formula: C13H11Br2N3S MolecularWeight: 401.11954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C1C#N)N)C2=C(C=C(C=C2SC)Br)Br

Isomeric SMILES

CC1=CN(C(=C1C#N)N)C2=C(C=C(C=C2SC)Br)Br

InChI

InChI=1S/C13H11Br2N3S/c1-7-6-18(13(17)9(7)5-16)12-10(15)3-8(14)4-11(12)19-2/h3-4,6H,17H2,1-2H3