2-(4-acetamidophenyl)sulfanyl-N-(1-adamantyl)propanamide

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-(1-adamantyl)propanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-(1-adamantyl)propanamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-(1-adamantyl)propanamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-(1-adamantyl)propanamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-(1-adamantyl)propionamide Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)SC4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)SC4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C21H28N2O2S/c1-13(26-19-5-3-18(4-6-19)22-14(2)24)20(25)23-21-10-15-7-16(11-21)9-17(8-15)12-21/h3-6,13,15-17H,7-12H2,1-2H3,(H,22,24)(H,23,25)