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

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

Systemtic Name:N-[(4-acetamidophenyl)carbamothioyl]-2-(1-adamantyl)ethanamide
Openeye Name:N-[(4-acetamidophenyl)carbamothioyl]-2-(1-adamantyl)acetamide
CAS Name:N-[(4-acetamidoanilino)-sulfanylidenemethyl]-2-(1-adamantyl)acetamide
IUPAC Name:N-[(4-acetamidophenyl)carbamothioyl]-2-(1-adamantyl)acetamide
Traditional Name:N-[(4-acetamidophenyl)thiocarbamoyl]-2-(1-adamantyl)acetamide
Formula: C21H27N3O2S
MolecularWeight: 385.52298
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3


Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3


InChI

InChI=1S/C21H27N3O2S/c1-13(25)22-17-2-4-18(5-3-17)23-20(27)24-19(26)12-21-9-14-6-15(10-21)8-16(7-14)11-21/h2-5,14-16H,6-12H2,1H3,(H,22,25)(H2,23,24,26,27)


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