N-(5-chloranyl-2-methyl-phenyl)-2-[1-(methylcarbamothioyl)-3-oxidanylidene-piperazin-2-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[1-(methylcarbamothioyl)-3-oxidanylidene-piperazin-2-yl]ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[1-(methylcarbamothioyl)-3-oxo-piperazin-2-yl]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[1-[methylamino(sulfanylidene)methyl]-3-oxo-2-piperazinyl]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[1-(methylcarbamothioyl)-3-oxopiperazin-2-yl]acetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[3-keto-1-(methylthiocarbamoyl)piperazin-2-yl]acetamide Formula: C15H19ClN4O2S MolecularWeight: 354.85496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)CC2C(=O)NCCN2C(=S)NC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)CC2C(=O)NCCN2C(=S)NC

InChI

InChI=1S/C15H19ClN4O2S/c1-9-3-4-10(16)7-11(9)19-13(21)8-12-14(22)18-5-6-20(12)15(23)17-2/h3-4,7,12H,5-6,8H2,1-2H3,(H,17,23)(H,18,22)(H,19,21)