S-[1-[[4-(4-ethoxyphenoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidin-3-yl] ethanethioate

Systemtic Name: S-[1-[[4-(4-ethoxyphenoxy)phenyl]methyl]-5-oxidanylidene-pyrrolidin-3-yl] ethanethioate Openeye Name: S-[1-[[4-(4-ethoxyphenoxy)phenyl]methyl]-5-oxo-pyrrolidin-3-yl] ethanethioate CAS Name: ethanethioic acid S-[1-[[4-(4-ethoxyphenoxy)phenyl]methyl]-5-oxo-3-pyrrolidinyl] ester IUPAC Name: S-[1-[[4-(4-ethoxyphenoxy)phenyl]methyl]-5-oxopyrrolidin-3-yl] ethanethioate Traditional Name: ethanethioic acid S-[1-[4-(4-ethoxyphenoxy)benzyl]-5-keto-pyrrolidin-3-yl] ester Formula: C21H23NO4S MolecularWeight: 385.47662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)CN3CC(CC3=O)SC(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC=C(C=C2)CN3CC(CC3=O)SC(=O)C

InChI

InChI=1S/C21H23NO4S/c1-3-25-17-8-10-19(11-9-17)26-18-6-4-16(5-7-18)13-22-14-20(12-21(22)24)27-15(2)23/h4-11,20H,3,12-14H2,1-2H3