ethyl 4-[3-(4-methylphenyl)sulfanylpropanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(4-methylphenyl)sulfanylpropanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(p-tolylsulfanyl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-[(4-methylphenyl)thio]-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-methylphenyl)sulfanylpropanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(p-tolylthio)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCSC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCSC2=CC=C(C=C2)C

InChI

InChI=1S/C17H24N2O3S/c1-3-22-17(21)19-11-9-18(10-12-19)16(20)8-13-23-15-6-4-14(2)5-7-15/h4-7H,3,8-13H2,1-2H3