N-[(2-methoxyphenyl)methyl]-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(2-methoxyphenyl)methyl]-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanyl-acetamide CAS Name: N-[(2-methoxyphenyl)methyl]-2-[[3-(1-pyrrolidinyl)-2-quinoxalinyl]thio]acetamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)sulfanylacetamide Traditional Name: N-o-anisyl-2-[(3-pyrrolidinoquinoxalin-2-yl)thio]acetamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CSC2=NC3=CC=CC=C3N=C2N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CSC2=NC3=CC=CC=C3N=C2N4CCCC4

InChI

InChI=1S/C22H24N4O2S/c1-28-19-11-5-2-8-16(19)14-23-20(27)15-29-22-21(26-12-6-7-13-26)24-17-9-3-4-10-18(17)25-22/h2-5,8-11H,6-7,12-15H2,1H3,(H,23,27)