2-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 2-[5-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 2-[4-allyl-5-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 2-[5-[(2-chloro-6-fluorophenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 2-[5-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 2-[4-allyl-5-[(2-chloro-6-fluoro-benzyl)thio]-1,2,4-triazol-3-yl]pyridine Formula: C17H14ClFN4S MolecularWeight: 360.836263

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)C3=CC=CC=N3

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)C3=CC=CC=N3

InChI

InChI=1S/C17H14ClFN4S/c1-2-10-23-16(15-8-3-4-9-20-15)21-22-17(23)24-11-12-13(18)6-5-7-14(12)19/h2-9H,1,10-11H2