2-methylsulfanyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)pyridine-3-carboxamide Traditional Name: 2-(methylthio)-N-(3-pyrrolidinoquinoxalin-2-yl)nicotinamide Formula: C19H19N5OS MolecularWeight: 365.45206

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NC2=NC3=CC=CC=C3N=C2N4CCCC4

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NC2=NC3=CC=CC=C3N=C2N4CCCC4

InChI

InChI=1S/C19H19N5OS/c1-26-19-13(7-6-10-20-19)18(25)23-16-17(24-11-4-5-12-24)22-15-9-3-2-8-14(15)21-16/h2-3,6-10H,4-5,11-12H2,1H3,(H,21,23,25)