3-bromanyl-1,7,7-trimethyl-2-oxidanylidene-N-(2-phenylsulfanylphenyl)bicyclo[2.2.1]heptane-4-carboxamide

Systemtic Name: 3-bromanyl-1,7,7-trimethyl-2-oxidanylidene-N-(2-phenylsulfanylphenyl)bicyclo[2.2.1]heptane-4-carboxamide Openeye Name: 2-bromo-4,7,7-trimethyl-3-oxo-N-(2-phenylsulfanylphenyl)norbornane-1-carboxamide CAS Name: 3-bromo-1,7,7-trimethyl-2-oxo-N-[2-(phenylthio)phenyl]-4-bicyclo[2.2.1]heptanecarboxamide IUPAC Name: 3-bromo-1,7,7-trimethyl-2-oxo-N-(2-phenylsulfanylphenyl)bicyclo[2.2.1]heptane-4-carboxamide Traditional Name: 2-bromo-3-keto-4,7,7-trimethyl-N-[2-(phenylthio)phenyl]norbornane-1-carboxamide Formula: C23H24BrNO2S MolecularWeight: 458.41116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24BrNO2S/c1-21(2)22(3)13-14-23(21,18(24)19(22)26)20(27)25-16-11-7-8-12-17(16)28-15-9-5-4-6-10-15/h4-12,18H,13-14H2,1-3H3,(H,25,27)