3-[4-bromanyl-4,4-bis(fluoranyl)butyl]sulfanyl-6-methyl-5-phenyl-1,2,4-triazine

Systemtic Name: 3-[4-bromanyl-4,4-bis(fluoranyl)butyl]sulfanyl-6-methyl-5-phenyl-1,2,4-triazine Openeye Name: 3-(4-bromo-4,4-difluoro-butyl)sulfanyl-6-methyl-5-phenyl-1,2,4-triazine CAS Name: 3-[(4-bromo-4,4-difluorobutyl)thio]-6-methyl-5-phenyl-1,2,4-triazine IUPAC Name: 3-(4-bromo-4,4-difluorobutyl)sulfanyl-6-methyl-5-phenyl-1,2,4-triazine Traditional Name: 3-[(4-bromo-4,4-difluoro-butyl)thio]-6-methyl-5-phenyl-1,2,4-triazine Formula: C14H14BrF2N3S MolecularWeight: 374.246866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SCCCC(F)(F)Br)C2=CC=CC=C2

Isomeric SMILES

CC1=C(N=C(N=N1)SCCCC(F)(F)Br)C2=CC=CC=C2

InChI

InChI=1S/C14H14BrF2N3S/c1-10-12(11-6-3-2-4-7-11)18-13(20-19-10)21-9-5-8-14(15,16)17/h2-4,6-7H,5,8-9H2,1H3