2-pyrrolidin-1-ylethyl 2-butylsulfanyl-2,2-diphenyl-ethanoate

Systemtic Name: 2-pyrrolidin-1-ylethyl 2-butylsulfanyl-2,2-diphenyl-ethanoate Openeye Name: 2-pyrrolidin-1-ylethyl 2-butylsulfanyl-2,2-diphenyl-acetate CAS Name: 2-(butylthio)-2,2-diphenylacetic acid 2-(1-pyrrolidinyl)ethyl ester IUPAC Name: 2-pyrrolidin-1-ylethyl 2-butylsulfanyl-2,2-diphenylacetate Traditional Name: 2-(butylthio)-2,2-diphenyl-acetic acid 2-pyrrolidinoethyl ester Formula: C24H31NO2S MolecularWeight: 397.57344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN3CCCC3

Isomeric SMILES

CCCCSC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN3CCCC3

InChI

InChI=1S/C24H31NO2S/c1-2-3-20-28-24(21-12-6-4-7-13-21,22-14-8-5-9-15-22)23(26)27-19-18-25-16-10-11-17-25/h4-9,12-15H,2-3,10-11,16-20H2,1H3