S-ethyl 3-methyl-1-(2-methylpropanoyl)-3-phenyl-piperidine-2-carbothioate

Systemtic Name: S-ethyl 3-methyl-1-(2-methylpropanoyl)-3-phenyl-piperidine-2-carbothioate Openeye Name: S-ethyl 3-methyl-1-(2-methylpropanoyl)-3-phenyl-piperidine-2-carbothioate CAS Name: 3-methyl-1-(2-methyl-1-oxopropyl)-3-phenyl-2-piperidinecarbothioic acid S-ethyl ester IUPAC Name: S-ethyl 3-methyl-1-(2-methylpropanoyl)-3-phenylpiperidine-2-carbothioate Traditional Name: 1-isobutyryl-3-methyl-3-phenyl-piperidine-2-carbothioic acid S-ethyl ester Formula: C19H27NO2S MolecularWeight: 333.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C1C(CCCN1C(=O)C(C)C)(C)C2=CC=CC=C2

Isomeric SMILES

CCSC(=O)C1C(CCCN1C(=O)C(C)C)(C)C2=CC=CC=C2

InChI

InChI=1S/C19H27NO2S/c1-5-23-18(22)16-19(4,15-10-7-6-8-11-15)12-9-13-20(16)17(21)14(2)3/h6-8,10-11,14,16H,5,9,12-13H2,1-4H3