5-bromanyl-N-[3-cyano-1-(3-oxidanylpropyl)pyrrolo[3,2-b]quinoxalin-2-yl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[3-cyano-1-(3-oxidanylpropyl)pyrrolo[3,2-b]quinoxalin-2-yl]furan-2-carboxamide Openeye Name: 5-bromo-N-[3-cyano-1-(3-hydroxypropyl)pyrrolo[3,2-b]quinoxalin-2-yl]furan-2-carboxamide CAS Name: 5-bromo-N-[3-cyano-1-(3-hydroxypropyl)-2-pyrrolo[3,2-b]quinoxalinyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[3-cyano-1-(3-hydroxypropyl)pyrrolo[3,2-b]quinoxalin-2-yl]furan-2-carboxamide Traditional Name: 5-bromo-N-[3-cyano-1-(3-hydroxypropyl)pyrrolo[3,2-b]quinoxalin-2-yl]-2-furamide Formula: C19H14BrN5O3 MolecularWeight: 440.25016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C3C(=C(N(C3=N2)CCCO)NC(=O)C4=CC=C(O4)Br)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C3C(=C(N(C3=N2)CCCO)NC(=O)C4=CC=C(O4)Br)C#N

InChI

InChI=1S/C19H14BrN5O3/c20-15-7-6-14(28-15)19(27)24-17-11(10-21)16-18(25(17)8-3-9-26)23-13-5-2-1-4-12(13)22-16/h1-2,4-7,26H,3,8-9H2,(H,24,27)