N-[(1R)-1-(1-adamantyl)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)ethanamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)ethanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(1,3-benzothiazol-2-ylthio)acetamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-(1,3-benzothiazol-2-ylthio)acetamide Formula: C21H26N2OS2 MolecularWeight: 386.57394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H26N2OS2/c1-13(21-9-14-6-15(10-21)8-16(7-14)11-21)22-19(24)12-25-20-23-17-4-2-3-5-18(17)26-20/h2-5,13-16H,6-12H2,1H3,(H,22,24)/t13-,14?,15?,16?,21?/m1/s1