N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]ethanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]ethanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]acetamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-[2-(4-ethoxyphenyl)-1-pyrrolidinyl]acetamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]acetamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-(2-p-phenetylpyrrolidino)acetamide Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2CC(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2CC(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C24H29N3O2S/c1-2-29-22-11-9-19(10-12-22)23-8-5-14-27(23)17-24(28)26-13-15-30-18-21-7-4-3-6-20(21)16-25/h3-4,6-7,9-12,23H,2,5,8,13-15,17-18H2,1H3,(H,26,28)