2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanylmethyl]-3-oxidanylidene-N-(pyridin-3-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanylmethyl]-3-oxidanylidene-N-(pyridin-3-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanylmethyl]-3-oxo-N-(3-pyridylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(2-chloro-6-fluorophenyl)methylthio]methyl]-3-oxo-N-(3-pyridinylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanylmethyl]-3-oxo-N-(pyridin-3-ylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[[(2-chloro-6-fluoro-benzyl)thio]methyl]-3-keto-N-(3-pyridylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C23H20ClFN4O2S MolecularWeight: 470.946903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCC4=CN=CC=C4)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCC4=CN=CC=C4)F

InChI

InChI=1S/C23H20ClFN4O2S/c24-17-4-1-5-18(25)16(17)12-32-13-21-23(31)29-20-9-15(6-7-19(20)28-21)22(30)27-11-14-3-2-8-26-10-14/h1-10,21,28H,11-13H2,(H,27,30)(H,29,31)