2-(1-adamantyl)-N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[(2-hydroxy-5-sec-butyl-phenyl)carbamothioyl]acetamide CAS Name: 2-(1-adamantyl)-N-[(5-butan-2-yl-2-hydroxyanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(5-butan-2-yl-2-hydroxyphenyl)carbamothioyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[(2-hydroxy-5-sec-butyl-phenyl)thiocarbamoyl]acetamide Formula: C23H32N2O2S MolecularWeight: 400.57738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H32N2O2S/c1-3-14(2)18-4-5-20(26)19(9-18)24-22(28)25-21(27)13-23-10-15-6-16(11-23)8-17(7-15)12-23/h4-5,9,14-17,26H,3,6-8,10-13H2,1-2H3,(H2,24,25,27,28)