2-azanyl-N,1-bis(3-methylbutyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N,1-bis(3-methylbutyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-N,1-diisopentyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N,1-bis(3-methylbutyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N,1-bis(3-methylbutyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-N,1-diisoamyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC(C)C)N

Isomeric SMILES

CC(C)CCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC(C)C)N

InChI

InChI=1S/C21H29N5O/c1-13(2)9-11-23-21(27)17-18-20(26(19(17)22)12-10-14(3)4)25-16-8-6-5-7-15(16)24-18/h5-8,13-14H,9-12,22H2,1-4H3,(H,23,27)