methyl 4-(3-cyclohexylsulfanyl-2-methyl-phenyl)piperazine-1-carboxylate

Systemtic Name: methyl 4-(3-cyclohexylsulfanyl-2-methyl-phenyl)piperazine-1-carboxylate Openeye Name: methyl 4-(3-cyclohexylsulfanyl-2-methyl-phenyl)piperazine-1-carboxylate CAS Name: 4-[3-(cyclohexylthio)-2-methylphenyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-cyclohexylsulfanyl-2-methylphenyl)piperazine-1-carboxylate Traditional Name: 4-[3-(cyclohexylthio)-2-methyl-phenyl]piperazine-1-carboxylic acid methyl ester Formula: C19H28N2O2S MolecularWeight: 348.50282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SC2CCCCC2)N3CCN(CC3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1SC2CCCCC2)N3CCN(CC3)C(=O)OC

InChI

InChI=1S/C19H28N2O2S/c1-15-17(20-11-13-21(14-12-20)19(22)23-2)9-6-10-18(15)24-16-7-4-3-5-8-16/h6,9-10,16H,3-5,7-8,11-14H2,1-2H3