N-(1-adamantyl)-2-(1,3-benzothiazol-2-ylsulfanyl)propanamide

Systemtic Name: N-(1-adamantyl)-2-(1,3-benzothiazol-2-ylsulfanyl)propanamide Openeye Name: N-(1-adamantyl)-2-(1,3-benzothiazol-2-ylsulfanyl)propanamide CAS Name: N-(1-adamantyl)-2-(1,3-benzothiazol-2-ylthio)propanamide IUPAC Name: N-(1-adamantyl)-2-(1,3-benzothiazol-2-ylsulfanyl)propanamide Traditional Name: N-(1-adamantyl)-2-(1,3-benzothiazol-2-ylthio)propionamide Formula: C20H24N2OS2 MolecularWeight: 372.54736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NC5=CC=CC=C5S4

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H24N2OS2/c1-12(24-19-21-16-4-2-3-5-17(16)25-19)18(23)22-20-9-13-6-14(10-20)8-15(7-13)11-20/h2-5,12-15H,6-11H2,1H3,(H,22,23)