ethyl 4-[1-(4-methyl-2-sulfanyl-phenyl)ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-(4-methyl-2-sulfanyl-phenyl)ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-(4-methyl-2-sulfanyl-phenyl)ethyl]piperazine-1-carboxylate CAS Name: 4-[1-(2-mercapto-4-methylphenyl)ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(4-methyl-2-sulfanylphenyl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[1-(2-mercapto-4-methyl-phenyl)ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2S/c1-4-20-16(19)18-9-7-17(8-10-18)13(3)14-6-5-12(2)11-15(14)21/h5-6,11,13,21H,4,7-10H2,1-3H3