2-(1-adamantyl)-N-[(4-ethoxyphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(4-ethoxyphenyl)carbamothioyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[(4-ethoxyphenyl)carbamothioyl]acetamide CAS Name: 2-(1-adamantyl)-N-[(4-ethoxyanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(4-ethoxyphenyl)carbamothioyl]acetamide Traditional Name: 2-(1-adamantyl)-N-(p-phenetylthiocarbamoyl)acetamide Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

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