N-(3-acetamidophenyl)-2-(1-adamantylsulfanyl)ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-(1-adamantylsulfanyl)ethanamide Openeye Name: N-(3-acetamidophenyl)-2-(1-adamantylsulfanyl)acetamide CAS Name: N-(3-acetamidophenyl)-2-(1-adamantylthio)acetamide IUPAC Name: N-(3-acetamidophenyl)-2-(1-adamantylsulfanyl)acetamide Traditional Name: N-(3-acetamidophenyl)-2-(1-adamantylthio)acetamide Formula: C20H26N2O2S MolecularWeight: 358.49764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26N2O2S/c1-13(23)21-17-3-2-4-18(8-17)22-19(24)12-25-20-9-14-5-15(10-20)7-16(6-14)11-20/h2-4,8,14-16H,5-7,9-12H2,1H3,(H,21,23)(H,22,24)