2-azanyl-1-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-N-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-N-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[(E)-(3,4-dimethoxyphenyl)methyleneamino]-N-pentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-N-pentyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-N-pentylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-amyl-1-[(E)-veratrylideneamino]pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H28N6O3 MolecularWeight: 460.52822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC(=C(C=C4)OC)OC)N

Isomeric SMILES

CCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)/N=C/C4=CC(=C(C=C4)OC)OC)N

InChI

InChI=1S/C25H28N6O3/c1-4-5-8-13-27-25(32)21-22-24(30-18-10-7-6-9-17(18)29-22)31(23(21)26)28-15-16-11-12-19(33-2)20(14-16)34-3/h6-7,9-12,14-15H,4-5,8,13,26H2,1-3H3,(H,27,32)/b28-15+