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

Systemtic Name: 4-[2-(2-bromanyl-4-fluoranyl-phenyl)sulfanyl-5-methyl-phenyl]-1,2,3,6-tetrahydropyridine Openeye Name: 4-[2-(2-bromo-4-fluoro-phenyl)sulfanyl-5-methyl-phenyl]-1,2,3,6-tetrahydropyridine CAS Name: 4-[2-[(2-bromo-4-fluorophenyl)thio]-5-methylphenyl]-1,2,3,6-tetrahydropyridine IUPAC Name: 4-[2-(2-bromo-4-fluorophenyl)sulfanyl-5-methylphenyl]-1,2,3,6-tetrahydropyridine Traditional Name: 4-[2-[(2-bromo-4-fluoro-phenyl)thio]-5-methyl-phenyl]-1,2,3,6-tetrahydropyridine Formula: C18H17BrFNS MolecularWeight: 378.301683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=C(C=C(C=C2)F)Br)C3=CCNCC3

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=C(C=C(C=C2)F)Br)C3=CCNCC3

InChI

InChI=1S/C18H17BrFNS/c1-12-2-4-17(15(10-12)13-6-8-21-9-7-13)22-18-5-3-14(20)11-16(18)19/h2-6,10-11,21H,7-9H2,1H3