N-[[4-(4-ethanoylpiperazin-1-yl)phenyl]carbamothioyl]-2-(4-ethylphenoxy)ethanamide

Systemtic Name: N-[[4-(4-ethanoylpiperazin-1-yl)phenyl]carbamothioyl]-2-(4-ethylphenoxy)ethanamide Openeye Name: N-[[4-(4-acetylpiperazin-1-yl)phenyl]carbamothioyl]-2-(4-ethylphenoxy)acetamide CAS Name: N-[[4-(4-acetyl-1-piperazinyl)anilino]-sulfanylidenemethyl]-2-(4-ethylphenoxy)acetamide IUPAC Name: N-[[4-(4-acetylpiperazin-1-yl)phenyl]carbamothioyl]-2-(4-ethylphenoxy)acetamide Traditional Name: N-[[4-(4-acetylpiperazino)phenyl]thiocarbamoyl]-2-(4-ethylphenoxy)acetamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C23H28N4O3S/c1-3-18-4-10-21(11-5-18)30-16-22(29)25-23(31)24-19-6-8-20(9-7-19)27-14-12-26(13-15-27)17(2)28/h4-11H,3,12-16H2,1-2H3,(H2,24,25,29,31)