ethyl 4-[(4-tert-butylphenyl)carbamothioyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(4-tert-butylphenyl)carbamothioyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(4-tert-butylphenyl)carbamothioyl]piperazine-1-carboxylate CAS Name: 4-[(4-tert-butylanilino)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-tert-butylphenyl)carbamothioyl]piperazine-1-carboxylate Traditional Name: 4-[(4-tert-butylphenyl)thiocarbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H27N3O2S MolecularWeight: 349.49088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C18H27N3O2S/c1-5-23-17(22)21-12-10-20(11-13-21)16(24)19-15-8-6-14(7-9-15)18(2,3)4/h6-9H,5,10-13H2,1-4H3,(H,19,24)