ethyl 4-[(phenylmethyl)carbamothioyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(phenylmethyl)carbamothioyl]piperazine-1-carboxylate Openeye Name: ethyl 4-(benzylcarbamothioyl)piperazine-1-carboxylate CAS Name: 4-[[(phenylmethyl)amino]-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzylcarbamothioyl)piperazine-1-carboxylate Traditional Name: 4-(benzylthiocarbamoyl)piperazine-1-carboxylic acid ethyl ester Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C15H21N3O2S/c1-2-20-15(19)18-10-8-17(9-11-18)14(21)16-12-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H,16,21)