ethyl 4-[(5-chloranyl-2-methoxy-phenyl)carbamothioyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(5-chloranyl-2-methoxy-phenyl)carbamothioyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(5-chloro-2-methoxy-phenyl)carbamothioyl]piperazine-1-carboxylate CAS Name: 4-[(5-chloro-2-methoxyanilino)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-chloro-2-methoxyphenyl)carbamothioyl]piperazine-1-carboxylate Traditional Name: 4-[(5-chloro-2-methoxy-phenyl)thiocarbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H20ClN3O3S MolecularWeight: 357.8556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20ClN3O3S/c1-3-22-15(20)19-8-6-18(7-9-19)14(23)17-12-10-11(16)4-5-13(12)21-2/h4-5,10H,3,6-9H2,1-2H3,(H,17,23)