N-[(1R)-1-(1-adamantyl)ethyl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]acetamide Formula: C23H30N2O2S2 MolecularWeight: 430.6265

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC(C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)N[C@H](C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H30N2O2S2/c1-3-27-18-4-5-19-20(9-18)29-22(25-19)28-13-21(26)24-14(2)23-10-15-6-16(11-23)8-17(7-15)12-23/h4-5,9,14-17H,3,6-8,10-13H2,1-2H3,(H,24,26)/t14-,15?,16?,17?,23?/m1/s1