ethyl 2-[4-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[(3-chloro-2-methyl-phenyl)carbamothioyl]piperazin-1-yl]acetate CAS Name: 2-[4-[(3-chloro-2-methylanilino)-sulfanylidenemethyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(3-chloro-2-methylphenyl)carbamothioyl]piperazin-1-yl]acetate Traditional Name: 2-[4-[(3-chloro-2-methyl-phenyl)thiocarbamoyl]piperazino]acetic acid ethyl ester Formula: C16H22ClN3O2S MolecularWeight: 355.88278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1)C(=S)NC2=C(C(=CC=C2)Cl)C

Isomeric SMILES

CCOC(=O)CN1CCN(CC1)C(=S)NC2=C(C(=CC=C2)Cl)C

InChI

InChI=1S/C16H22ClN3O2S/c1-3-22-15(21)11-19-7-9-20(10-8-19)16(23)18-14-6-4-5-13(17)12(14)2/h4-6H,3,7-11H2,1-2H3,(H,18,23)