3-(7-fluoranyl-4-oxidanylidene-pyrrolo[1,2-a]quinoxalin-5-yl)-N-[(4-methylsulfanylphenyl)methyl]propanamide

Systemtic Name: 3-(7-fluoranyl-4-oxidanylidene-pyrrolo[1,2-a]quinoxalin-5-yl)-N-[(4-methylsulfanylphenyl)methyl]propanamide Openeye Name: 3-(7-fluoro-4-oxo-pyrrolo[1,2-a]quinoxalin-5-yl)-N-[(4-methylsulfanylphenyl)methyl]propanamide CAS Name: 3-(7-fluoro-4-oxo-5-pyrrolo[1,2-a]quinoxalinyl)-N-[[4-(methylthio)phenyl]methyl]propanamide IUPAC Name: 3-(7-fluoro-4-oxopyrrolo[1,2-a]quinoxalin-5-yl)-N-[(4-methylsulfanylphenyl)methyl]propanamide Traditional Name: 3-(7-fluoro-4-keto-pyrrolo[1,2-a]quinoxalin-5-yl)-N-[4-(methylthio)benzyl]propionamide Formula: C22H20FN3O2S MolecularWeight: 409.476503

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)CCN2C3=C(C=CC(=C3)F)N4C=CC=C4C2=O

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)CCN2C3=C(C=CC(=C3)F)N4C=CC=C4C2=O

InChI

InChI=1S/C22H20FN3O2S/c1-29-17-7-4-15(5-8-17)14-24-21(27)10-12-26-20-13-16(23)6-9-18(20)25-11-2-3-19(25)22(26)28/h2-9,11,13H,10,12,14H2,1H3,(H,24,27)