5-azanyl-1-[2-chloranyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfanylmethyl)pyrazole-3-carbonitrile

Systemtic Name: 5-azanyl-1-[2-chloranyl-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfanylmethyl)pyrazole-3-carbonitrile Openeye Name: 5-amino-1-[2-chloro-4-(trifluoromethyl)phenyl]-4-(isopropylsulfanylmethyl)pyrazole-3-carbonitrile CAS Name: 5-amino-1-[2-chloro-4-(trifluoromethyl)phenyl]-4-[(propan-2-ylthio)methyl]-3-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[2-chloro-4-(trifluoromethyl)phenyl]-4-(propan-2-ylsulfanylmethyl)pyrazole-3-carbonitrile Traditional Name: 5-amino-1-[2-chloro-4-(trifluoromethyl)phenyl]-4-[(isopropylthio)methyl]pyrazole-3-carbonitrile Formula: C15H14ClF3N4S MolecularWeight: 374.81167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC1=C(N(N=C1C#N)C2=C(C=C(C=C2)C(F)(F)F)Cl)N

Isomeric SMILES

CC(C)SCC1=C(N(N=C1C#N)C2=C(C=C(C=C2)C(F)(F)F)Cl)N

InChI

InChI=1S/C15H14ClF3N4S/c1-8(2)24-7-10-12(6-20)22-23(14(10)21)13-4-3-9(5-11(13)16)15(17,18)19/h3-5,8H,7,21H2,1-2H3