2-azanyl-1-hexyl-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-hexyl-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-hexyl-N-(1-methyl-3-phenyl-propyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-hexyl-N-(4-phenylbutan-2-yl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-hexyl-N-(4-phenylbutan-2-yl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-hexyl-N-(1-methyl-3-phenyl-propyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC(C)CCC4=CC=CC=C4)N

Isomeric SMILES

CCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NC(C)CCC4=CC=CC=C4)N

InChI

InChI=1S/C27H33N5O/c1-3-4-5-11-18-32-25(28)23(24-26(32)31-22-15-10-9-14-21(22)30-24)27(33)29-19(2)16-17-20-12-7-6-8-13-20/h6-10,12-15,19H,3-5,11,16-18,28H2,1-2H3,(H,29,33)