N-(2-ethylphenyl)-N-[4-[[(3-oxidanylidenepiperazin-1-yl)carbothioylamino]methyl]-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-N-[4-[[(3-oxidanylidenepiperazin-1-yl)carbothioylamino]methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-N-[4-[[(3-oxopiperazine-1-carbothioyl)amino]methyl]thiazol-2-yl]acetamide CAS Name: N-(2-ethylphenyl)-N-[4-[[[(3-oxo-1-piperazinyl)-sulfanylidenemethyl]amino]methyl]-2-thiazolyl]acetamide IUPAC Name: N-(2-ethylphenyl)-N-[4-[[(3-oxopiperazine-1-carbothioyl)amino]methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-(2-ethylphenyl)-N-[4-[[(3-ketopiperazine-1-carbothioyl)amino]methyl]thiazol-2-yl]acetamide Formula: C19H23N5O2S2 MolecularWeight: 417.54822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(C2=NC(=CS2)CNC(=S)N3CCNC(=O)C3)C(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N(C2=NC(=CS2)CNC(=S)N3CCNC(=O)C3)C(=O)C

InChI

InChI=1S/C19H23N5O2S2/c1-3-14-6-4-5-7-16(14)24(13(2)25)19-22-15(12-28-19)10-21-18(27)23-9-8-20-17(26)11-23/h4-7,12H,3,8-11H2,1-2H3,(H,20,26)(H,21,27)