ethyl 4-[(2-cyanophenyl)carbamothioyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2-cyanophenyl)carbamothioyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(2-cyanophenyl)carbamothioyl]piperazine-1-carboxylate CAS Name: 4-[(2-cyanoanilino)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-cyanophenyl)carbamothioyl]piperazine-1-carboxylate Traditional Name: 4-[(2-cyanophenyl)thiocarbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=CC=C2C#N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=CC=C2C#N

InChI

InChI=1S/C15H18N4O2S/c1-2-21-15(20)19-9-7-18(8-10-19)14(22)17-13-6-4-3-5-12(13)11-16/h3-6H,2,7-10H2,1H3,(H,17,22)