N-[1-(1-adamantyl)ethyl]-4-(1,3-dithiolan-2-yl)benzamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-4-(1,3-dithiolan-2-yl)benzamide Openeye Name: N-[1-(1-adamantyl)ethyl]-4-(1,3-dithiolan-2-yl)benzamide CAS Name: N-[1-(1-adamantyl)ethyl]-4-(1,3-dithiolan-2-yl)benzamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-4-(1,3-dithiolan-2-yl)benzamide Traditional Name: N-[1-(1-adamantyl)ethyl]-4-(1,3-dithiolan-2-yl)benzamide Formula: C22H29NOS2 MolecularWeight: 387.60176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=C(C=C4)C5SCCS5

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=C(C=C4)C5SCCS5

InChI

InChI=1S/C22H29NOS2/c1-14(22-11-15-8-16(12-22)10-17(9-15)13-22)23-20(24)18-2-4-19(5-3-18)21-25-6-7-26-21/h2-5,14-17,21H,6-13H2,1H3,(H,23,24)