6-bromanyl-1,5,5-trimethyl-N-(2-phenylsulfanylphenyl)bicyclo[2.1.1]hexane-4-carboxamide

Systemtic Name: 6-bromanyl-1,5,5-trimethyl-N-(2-phenylsulfanylphenyl)bicyclo[2.1.1]hexane-4-carboxamide Openeye Name: 6-bromo-1,5,5-trimethyl-N-(2-phenylsulfanylphenyl)bicyclo[2.1.1]hexane-4-carboxamide CAS Name: 6-bromo-1,5,5-trimethyl-N-[2-(phenylthio)phenyl]-4-bicyclo[2.1.1]hexanecarboxamide IUPAC Name: 6-bromo-1,5,5-trimethyl-N-(2-phenylsulfanylphenyl)bicyclo[2.1.1]hexane-4-carboxamide Traditional Name: 6-bromo-1,5,5-trimethyl-N-[2-(phenylthio)phenyl]bicyclo[2.1.1]hexane-4-carboxamide Formula: C22H24BrNOS MolecularWeight: 430.40106

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(CCC1(C2Br)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C)C

Isomeric SMILES

CC1(C2(CCC1(C2Br)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C)C

InChI

InChI=1S/C22H24BrNOS/c1-20(2)21(3)13-14-22(20,18(21)23)19(25)24-16-11-7-8-12-17(16)26-15-9-5-4-6-10-15/h4-12,18H,13-14H2,1-3H3,(H,24,25)