2-azanyl-1-(1,3-benzodioxol-5-yl)-N-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(1,3-benzodioxol-5-yl)-N-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(1,3-benzodioxol-5-yl)-N-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(1,3-benzodioxol-5-yl)-N-butyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(1,3-benzodioxol-5-yl)-N-butylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(1,3-benzodioxol-5-yl)-N-butyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

CCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C22H21N5O3/c1-2-3-10-24-22(28)18-19-21(26-15-7-5-4-6-14(15)25-19)27(20(18)23)13-8-9-16-17(11-13)30-12-29-16/h4-9,11H,2-3,10,12,23H2,1H3,(H,24,28)