(1R,5S)-5-(4-bromophenyl)-3-[3-[[4-methyl-5-(2-methylpyridin-3-yl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-3-azabicyclo[3.1.0]hexane

Systemtic Name: (1R,5S)-5-(4-bromophenyl)-3-[3-[[4-methyl-5-(2-methylpyridin-3-yl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-3-azabicyclo[3.1.0]hexane Openeye Name: (1R,5S)-5-(4-bromophenyl)-3-[3-[[4-methyl-5-(2-methyl-3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-3-azabicyclo[3.1.0]hexane CAS Name: (1R,5S)-5-(4-bromophenyl)-3-[3-[[4-methyl-5-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-yl]thio]propyl]-3-azabicyclo[3.1.0]hexane IUPAC Name: (1R,5S)-5-(4-bromophenyl)-3-[3-[[4-methyl-5-(2-methylpyridin-3-yl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-3-azabicyclo[3.1.0]hexane Traditional Name: (1R,5S)-5-(4-bromophenyl)-3-[3-[[4-methyl-5-(2-methyl-3-pyridyl)-1,2,4-triazol-3-yl]thio]propyl]-3-azabicyclo[3.1.0]hexane Formula: C23H26BrN5S MolecularWeight: 484.45504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)C2=NN=C(N2C)SCCCN3CC4CC4(C3)C5=CC=C(C=C5)Br

Isomeric SMILES

CC1=C(C=CC=N1)C2=NN=C(N2C)SCCCN3C[C@@H]4C[C@@]4(C3)C5=CC=C(C=C5)Br

InChI

InChI=1S/C23H26BrN5S/c1-16-20(5-3-10-25-16)21-26-27-22(28(21)2)30-12-4-11-29-14-18-13-23(18,15-29)17-6-8-19(24)9-7-17/h3,5-10,18H,4,11-15H2,1-2H3/t18-,23+/m0/s1