N-[3-cyano-1-(2-methoxyethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[3-cyano-1-(2-methoxyethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[3-cyano-1-(2-methoxyethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-fluoro-benzamide CAS Name: N-[3-cyano-1-(2-methoxyethyl)-2-pyrrolo[3,2-b]quinoxalinyl]-4-fluorobenzamide IUPAC Name: N-[3-cyano-1-(2-methoxyethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-fluorobenzamide Traditional Name: N-[3-cyano-1-(2-methoxyethyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-fluoro-benzamide Formula: C21H16FN5O2 MolecularWeight: 389.382443

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN5O2/c1-29-11-10-27-19(26-21(28)13-6-8-14(22)9-7-13)15(12-23)18-20(27)25-17-5-3-2-4-16(17)24-18/h2-9H,10-11H2,1H3,(H,26,28)