N-[(1R)-1-(1-adamantyl)ethyl]-2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4H-3,1-benzothiazin-2-ylthio)acetamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(4H-3,1-benzothiazin-2-ylthio)acetamide Formula: C22H28N2OS2 MolecularWeight: 400.60052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CSC4=NC5=CC=CC=C5CS4

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CSC4=NC5=CC=CC=C5CS4

InChI

InChI=1S/C22H28N2OS2/c1-14(22-9-15-6-16(10-22)8-17(7-15)11-22)23-20(25)13-27-21-24-19-5-3-2-4-18(19)12-26-21/h2-5,14-17H,6-13H2,1H3,(H,23,25)/t14-,15?,16?,17?,22?/m1/s1