(1S,3S,4R)-4-butyl-3-phenylsulfanyl-7-azabicyclo[2.2.1]heptane

Systemtic Name: (1S,3S,4R)-4-butyl-3-phenylsulfanyl-7-azabicyclo[2.2.1]heptane Openeye Name: (1S,3S,4R)-4-butyl-3-phenylsulfanyl-7-azabicyclo[2.2.1]heptane CAS Name: (1S,3S,4R)-4-butyl-3-(phenylthio)-7-azabicyclo[2.2.1]heptane IUPAC Name: (1S,3S,4R)-4-butyl-3-phenylsulfanyl-7-azabicyclo[2.2.1]heptane Traditional Name: (1S,3S,4R)-4-butyl-3-(phenylthio)-7-azabicyclo[2.2.1]heptane Formula: C16H23NS MolecularWeight: 261.42552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC12CCC(N1)CC2SC3=CC=CC=C3

Isomeric SMILES

CCCC[C@]12CC[C@H](N1)C[C@@H]2SC3=CC=CC=C3

InChI

InChI=1S/C16H23NS/c1-2-3-10-16-11-9-13(17-16)12-15(16)18-14-7-5-4-6-8-14/h4-8,13,15,17H,2-3,9-12H2,1H3/t13-,15-,16+/m0/s1