5-azanyl-1-[4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfanyl)pyrrole-3-carbonitrile

Systemtic Name: 5-azanyl-1-[4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfanyl)pyrrole-3-carbonitrile Openeye Name: 5-amino-1-[4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfanyl)pyrrole-3-carbonitrile CAS Name: 5-amino-1-[4-(trifluoromethyl)phenyl]-4-(trifluoromethylthio)-3-pyrrolecarbonitrile IUPAC Name: 5-amino-1-[4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfanyl)pyrrole-3-carbonitrile Traditional Name: 5-amino-1-[4-(trifluoromethyl)phenyl]-4-(trifluoromethylthio)pyrrole-3-carbonitrile Formula: C13H7F6N3S MolecularWeight: 351.270199

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)N2C=C(C(=C2N)SC(F)(F)F)C#N

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)N2C=C(C(=C2N)SC(F)(F)F)C#N

InChI

InChI=1S/C13H7F6N3S/c14-12(15,16)8-1-3-9(4-2-8)22-6-7(5-20)10(11(22)21)23-13(17,18)19/h1-4,6H,21H2