2-azanyl-1-butyl-N-(2-piperidin-1-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-butyl-N-(2-piperidin-1-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-butyl-N-[2-(1-piperidyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-butyl-N-[2-(1-piperidinyl)ethyl]-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-butyl-N-(2-piperidin-1-ylethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-butyl-N-(2-piperidinoethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C22H30N6O MolecularWeight: 394.5132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NCCN4CCCCC4)N

Isomeric SMILES

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)NCCN4CCCCC4)N

InChI

InChI=1S/C22H30N6O/c1-2-3-14-28-20(23)18(22(29)24-11-15-27-12-7-4-8-13-27)19-21(28)26-17-10-6-5-9-16(17)25-19/h5-6,9-10H,2-4,7-8,11-15,23H2,1H3,(H,24,29)