2-(4-cyclohexylphenoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-cyclohexylphenoxy)-N-[(pyridin-4-ylcarbonylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-cyclohexylphenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide CAS Name: 2-(4-cyclohexylphenoxy)-N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-cyclohexylphenoxy)-N-[(pyridine-4-carbonylamino)carbamothioyl]acetamide Traditional Name: 2-(4-cyclohexylphenoxy)-N-(isonicotinamidothiocarbamoyl)acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC(=S)NNC(=O)C3=CC=NC=C3

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)OCC(=O)NC(=S)NNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C21H24N4O3S/c26-19(23-21(29)25-24-20(27)17-10-12-22-13-11-17)14-28-18-8-6-16(7-9-18)15-4-2-1-3-5-15/h6-13,15H,1-5,14H2,(H,24,27)(H2,23,25,26,29)