methyl 4-(3-cyclohexylsulfanylphenyl)piperazine-1-carboxylate

Systemtic Name: methyl 4-(3-cyclohexylsulfanylphenyl)piperazine-1-carboxylate Openeye Name: methyl 4-(3-cyclohexylsulfanylphenyl)piperazine-1-carboxylate CAS Name: 4-[3-(cyclohexylthio)phenyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-cyclohexylsulfanylphenyl)piperazine-1-carboxylate Traditional Name: 4-[3-(cyclohexylthio)phenyl]piperazine-1-carboxylic acid methyl ester Formula: C18H26N2O2S MolecularWeight: 334.47624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)C2=CC(=CC=C2)SC3CCCCC3

Isomeric SMILES

COC(=O)N1CCN(CC1)C2=CC(=CC=C2)SC3CCCCC3

InChI

InChI=1S/C18H26N2O2S/c1-22-18(21)20-12-10-19(11-13-20)15-6-5-9-17(14-15)23-16-7-3-2-4-8-16/h5-6,9,14,16H,2-4,7-8,10-13H2,1H3