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

Systemtic Name: ethyl 4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazine-1-carboxylate CAS Name: 4-[(4-methoxycarbonylanilino)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-methoxycarbonylphenyl)carbamothioyl]piperazine-1-carboxylate Traditional Name: 4-[(4-carbomethoxyphenyl)thiocarbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O4S/c1-3-23-16(21)19-10-8-18(9-11-19)15(24)17-13-6-4-12(5-7-13)14(20)22-2/h4-7H,3,8-11H2,1-2H3,(H,17,24)