4-[5-[[2,6-bis(fluoranyl)phenyl]methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-[[2,6-bis(fluoranyl)phenyl]methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(2,6-difluorophenyl)methylsulfanyl]-4-(p-tolyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(2,6-difluorophenyl)methylthio]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(2,6-difluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(2,6-difluorobenzyl)thio]-4-(p-tolyl)-1,2,4-triazol-3-yl]pyridine Formula: C21H16F2N4S MolecularWeight: 394.440346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3F)F)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3F)F)C4=CC=NC=C4

InChI

InChI=1S/C21H16F2N4S/c1-14-5-7-16(8-6-14)27-20(15-9-11-24-12-10-15)25-26-21(27)28-13-17-18(22)3-2-4-19(17)23/h2-12H,13H2,1H3