ethyl 4-[(4-methylphenyl)carbonylcarbamothioyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(4-methylphenyl)carbonylcarbamothioyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(4-methylbenzoyl)carbamothioyl]piperazine-1-carboxylate CAS Name: 4-[[[(4-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-methylbenzoyl)carbamothioyl]piperazine-1-carboxylate Traditional Name: 4-(p-toluoylthiocarbamoyl)piperazine-1-carboxylic acid ethyl ester Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H21N3O3S/c1-3-22-16(21)19-10-8-18(9-11-19)15(23)17-14(20)13-6-4-12(2)5-7-13/h4-7H,3,8-11H2,1-2H3,(H,17,20,23)