3-[4-[2-(2-chloranylphenoxy)ethyl]piperazin-1-yl]-N-(3-cyanothiophen-2-yl)propanamide

Systemtic Name: 3-[4-[2-(2-chloranylphenoxy)ethyl]piperazin-1-yl]-N-(3-cyanothiophen-2-yl)propanamide Openeye Name: 3-[4-[2-(2-chlorophenoxy)ethyl]piperazin-1-yl]-N-(3-cyano-2-thienyl)propanamide CAS Name: 3-[4-[2-(2-chlorophenoxy)ethyl]-1-piperazinyl]-N-(3-cyano-2-thiophenyl)propanamide IUPAC Name: 3-[4-[2-(2-chlorophenoxy)ethyl]piperazin-1-yl]-N-(3-cyanothiophen-2-yl)propanamide Traditional Name: 3-[4-[2-(2-chlorophenoxy)ethyl]piperazino]-N-(3-cyano-2-thienyl)propionamide Formula: C20H23ClN4O2S MolecularWeight: 418.94022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C#N)CCOC3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=C(C=CS2)C#N)CCOC3=CC=CC=C3Cl

InChI

InChI=1S/C20H23ClN4O2S/c21-17-3-1-2-4-18(17)27-13-12-25-10-8-24(9-11-25)7-5-19(26)23-20-16(15-22)6-14-28-20/h1-4,6,14H,5,7-13H2,(H,23,26)