N-[(1R)-1-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]ethyl]-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[(1R)-1-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]ethyl]-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]-N-[(1R)-1-[(1R,2R,4S)-norbornan-2-yl]ethyl]acetamide CAS Name: N-[(1R)-1-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]ethyl]-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)thio]acetamide IUPAC Name: N-[(1R)-1-[(1S,3R,4R)-3-bicyclo[2.2.1]heptanyl]ethyl]-2-[(5-ethylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]acetamide Traditional Name: 2-[(5-esyl-1,3-benzoxazol-2-yl)thio]-N-[(1R)-1-[(1R,2R,4S)-norbornan-2-yl]ethyl]acetamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)NC(C)C3CC4CCC3C4

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)N[C@H](C)[C@@H]3C[C@H]4CC[C@@H]3C4

InChI

InChI=1S/C20H26N2O4S2/c1-3-28(24,25)15-6-7-18-17(10-15)22-20(26-18)27-11-19(23)21-12(2)16-9-13-4-5-14(16)8-13/h6-7,10,12-14,16H,3-5,8-9,11H2,1-2H3,(H,21,23)/t12-,13+,14-,16+/m1/s1