2-diethylaminoethyl 2-pentylsulfanyl-2,2-diphenyl-ethanoate

Systemtic Name: 2-diethylaminoethyl 2-pentylsulfanyl-2,2-diphenyl-ethanoate Openeye Name: 2-diethylaminoethyl 2-pentylsulfanyl-2,2-diphenyl-acetate CAS Name: 2-(pentylthio)-2,2-diphenylacetic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 2-pentylsulfanyl-2,2-diphenylacetate Traditional Name: 2-(amylthio)-2,2-diphenyl-acetic acid 2-diethylaminoethyl ester Formula: C25H35NO2S MolecularWeight: 413.6159

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN(CC)CC

Isomeric SMILES

CCCCCSC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN(CC)CC

InChI

InChI=1S/C25H35NO2S/c1-4-7-14-21-29-25(22-15-10-8-11-16-22,23-17-12-9-13-18-23)24(27)28-20-19-26(5-2)6-3/h8-13,15-18H,4-7,14,19-21H2,1-3H3