N-[2-(4-chlorophenyl)ethyl]-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanyl-acetamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-2-[[3-(1-pyrrolidinyl)-2-quinoxalinyl]thio]acetamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanylacetamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-2-[(3-pyrrolidinoquinoxalin-2-yl)thio]acetamide Formula: C22H23ClN4OS MolecularWeight: 426.96222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)C2=NC3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H23ClN4OS/c23-17-9-7-16(8-10-17)11-12-24-20(28)15-29-22-21(27-13-3-4-14-27)25-18-5-1-2-6-19(18)26-22/h1-2,5-10H,3-4,11-15H2,(H,24,28)