2-diethylaminoethyl 2-cyclohexyl-2-phenyl-2-sulfanyl-ethanoate

Systemtic Name: 2-diethylaminoethyl 2-cyclohexyl-2-phenyl-2-sulfanyl-ethanoate Openeye Name: 2-diethylaminoethyl 2-cyclohexyl-2-phenyl-2-sulfanyl-acetate CAS Name: 2-cyclohexyl-2-mercapto-2-phenylacetic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 2-cyclohexyl-2-phenyl-2-sulfanylacetate Traditional Name: 2-cyclohexyl-2-mercapto-2-phenyl-acetic acid 2-diethylaminoethyl ester Formula: C20H31NO2S MolecularWeight: 349.53064

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)S

Isomeric SMILES

CCN(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)S

InChI

InChI=1S/C20H31NO2S/c1-3-21(4-2)15-16-23-19(22)20(24,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5,7-8,11-12,18,24H,3-4,6,9-10,13-16H2,1-2H3