5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-butan-2-ylsulfanyl-pyrazole-3-carbonitrile

Systemtic Name: 5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-butan-2-ylsulfanyl-pyrazole-3-carbonitrile Openeye Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-sec-butylsulfanyl-pyrazole-3-carbonitrile CAS Name: 5-amino-4-(butan-2-ylthio)-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-3-pyrazolecarbonitrile IUPAC Name: 5-amino-4-butan-2-ylsulfanyl-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazole-3-carbonitrile Traditional Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(sec-butylthio)pyrazole-3-carbonitrile Formula: C15H13Cl2F3N4S MolecularWeight: 409.25673

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=C(N(N=C1C#N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)N

Isomeric SMILES

CCC(C)SC1=C(N(N=C1C#N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)N

InChI

InChI=1S/C15H13Cl2F3N4S/c1-3-7(2)25-13-11(6-21)23-24(14(13)22)12-9(16)4-8(5-10(12)17)15(18,19)20/h4-5,7H,3,22H2,1-2H3