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

Systemtic Name: 5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-prop-2-enylsulfanyl-pyrazole-3-carbonitrile Openeye Name: 4-allylsulfanyl-5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazole-3-carbonitrile CAS Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(prop-2-enylthio)-3-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-prop-2-enylsulfanylpyrazole-3-carbonitrile Traditional Name: 4-(allylthio)-5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazole-3-carbonitrile Formula: C14H9Cl2F3N4S MolecularWeight: 393.21427

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(N(N=C1C#N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)N

Isomeric SMILES

C=CCSC1=C(N(N=C1C#N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)N

InChI

InChI=1S/C14H9Cl2F3N4S/c1-2-3-24-12-10(6-20)22-23(13(12)21)11-8(15)4-7(5-9(11)16)14(17,18)19/h2,4-5H,1,3,21H2