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

Systemtic Name: N-[3-cyano-1-(3-oxidanylpropyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Openeye Name: N-[3-cyano-1-(3-hydroxypropyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide CAS Name: N-[3-cyano-1-(3-hydroxypropyl)-2-pyrrolo[3,2-b]quinoxalinyl]benzamide IUPAC Name: N-[3-cyano-1-(3-hydroxypropyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Traditional Name: N-[3-cyano-1-(3-hydroxypropyl)pyrrolo[3,2-b]quinoxalin-2-yl]benzamide Formula: C21H17N5O2 MolecularWeight: 371.39198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C(C3=NC4=CC=CC=C4N=C3N2CCCO)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C(C3=NC4=CC=CC=C4N=C3N2CCCO)C#N

InChI

InChI=1S/C21H17N5O2/c22-13-15-18-20(24-17-10-5-4-9-16(17)23-18)26(11-6-12-27)19(15)25-21(28)14-7-2-1-3-8-14/h1-5,7-10,27H,6,11-12H2,(H,25,28)