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

Systemtic Name: N-(2-ethylphenyl)-N-[4-[[(4-methylpiperidin-1-yl)carbothioylamino]methyl]-1,3-thiazol-2-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-N-[4-[[(4-methylpiperidine-1-carbothioyl)amino]methyl]thiazol-2-yl]acetamide CAS Name: N-(2-ethylphenyl)-N-[4-[[[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]amino]methyl]-2-thiazolyl]acetamide IUPAC Name: N-(2-ethylphenyl)-N-[4-[[(4-methylpiperidine-1-carbothioyl)amino]methyl]-1,3-thiazol-2-yl]acetamide Traditional Name: N-(2-ethylphenyl)-N-[4-[[(4-methylpiperidine-1-carbothioyl)amino]methyl]thiazol-2-yl]acetamide Formula: C21H28N4OS2 MolecularWeight: 416.60322

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(C2=NC(=CS2)CNC(=S)N3CCC(CC3)C)C(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N(C2=NC(=CS2)CNC(=S)N3CCC(CC3)C)C(=O)C

InChI

InChI=1S/C21H28N4OS2/c1-4-17-7-5-6-8-19(17)25(16(3)26)21-23-18(14-28-21)13-22-20(27)24-11-9-15(2)10-12-24/h5-8,14-15H,4,9-13H2,1-3H3,(H,22,27)