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

Systemtic Name: ethyl 4-[3-[4-(4-methylphenyl)sulfanylcarbonylphenoxy]propyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[4-(p-tolylsulfanylcarbonyl)phenoxy]propyl]piperazine-1-carboxylate CAS Name: 4-[3-[4-[[(4-methylphenyl)thio]-oxomethyl]phenoxy]propyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[4-(4-methylphenyl)sulfanylcarbonylphenoxy]propyl]piperazine-1-carboxylate Traditional Name: 4-[3-[4-(p-tolylthio)carbonylphenoxy]propyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)SC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)SC3=CC=C(C=C3)C

InChI

InChI=1S/C24H30N2O4S/c1-3-29-24(28)26-16-14-25(15-17-26)13-4-18-30-21-9-7-20(8-10-21)23(27)31-22-11-5-19(2)6-12-22/h5-12H,3-4,13-18H2,1-2H3