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

Systemtic Name: N-(1-butyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-4-(dimethylaminomethyl)benzamide Openeye Name: N-(1-butyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-4-(dimethylaminomethyl)benzamide CAS Name: N-(1-butyl-3-cyano-2-pyrrolo[3,2-b]quinoxalinyl)-4-(dimethylaminomethyl)benzamide IUPAC Name: N-(1-butyl-3-cyanopyrrolo[3,2-b]quinoxalin-2-yl)-4-(dimethylaminomethyl)benzamide Traditional Name: N-(1-butyl-3-cyano-pyrrolo[3,2-b]quinoxalin-2-yl)-4-(dimethylaminomethyl)benzamide Formula: C25H26N6O MolecularWeight: 426.51354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C4=CC=C(C=C4)CN(C)C

Isomeric SMILES

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C#N)NC(=O)C4=CC=C(C=C4)CN(C)C

InChI

InChI=1S/C25H26N6O/c1-4-5-14-31-23(29-25(32)18-12-10-17(11-13-18)16-30(2)3)19(15-26)22-24(31)28-21-9-7-6-8-20(21)27-22/h6-13H,4-5,14,16H2,1-3H3,(H,29,32)