2-azanyl-N-heptyl-1-(3-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-heptyl-1-(3-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N-heptyl-1-(m-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-heptyl-1-(3-methylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-heptyl-1-(3-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N-heptyl-1-(m-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C25H29N5O MolecularWeight: 415.53066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=CC(=C4)C)N

Isomeric SMILES

CCCCCCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=CC(=C4)C)N

InChI

InChI=1S/C25H29N5O/c1-3-4-5-6-9-15-27-25(31)21-22-24(29-20-14-8-7-13-19(20)28-22)30(23(21)26)18-12-10-11-17(2)16-18/h7-8,10-14,16H,3-6,9,15,26H2,1-2H3,(H,27,31)