N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(5-methylsulfanyl-3-pyridin-3-yl-pyrazol-1-yl)aniline

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(5-methylsulfanyl-3-pyridin-3-yl-pyrazol-1-yl)aniline Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-4-[5-methylsulfanyl-3-(3-pyridyl)pyrazol-1-yl]aniline CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-4-[5-(methylthio)-3-(3-pyridinyl)-1-pyrazolyl]aniline IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-4-(5-methylsulfanyl-3-pyridin-3-ylpyrazol-1-yl)aniline Traditional Name: (2-chloro-6-fluoro-benzyl)-[4-[5-(methylthio)-3-(3-pyridyl)pyrazol-1-yl]phenyl]amine Formula: C22H18ClFN4S MolecularWeight: 424.921523

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=NN1C2=CC=C(C=C2)NCC3=C(C=CC=C3Cl)F)C4=CN=CC=C4

Isomeric SMILES

CSC1=CC(=NN1C2=CC=C(C=C2)NCC3=C(C=CC=C3Cl)F)C4=CN=CC=C4

InChI

InChI=1S/C22H18ClFN4S/c1-29-22-12-21(15-4-3-11-25-13-15)27-28(22)17-9-7-16(8-10-17)26-14-18-19(23)5-2-6-20(18)24/h2-13,26H,14H2,1H3