ethyl 4-(phenethylcarbamothioyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(phenethylcarbamothioyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(phenethylcarbamothioyl)piperazine-1-carboxylate CAS Name: 4-[(phenethylamino)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(phenethylcarbamothioyl)piperazine-1-carboxylate Traditional Name: 4-(phenethylthiocarbamoyl)piperazine-1-carboxylic acid ethyl ester Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C16H23N3O2S/c1-2-21-16(20)19-12-10-18(11-13-19)15(22)17-9-8-14-6-4-3-5-7-14/h3-7H,2,8-13H2,1H3,(H,17,22)