2-azanyl-1-[4-chloranyl-3-(trifluoromethyl)phenyl]-N-propyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-[4-chloranyl-3-(trifluoromethyl)phenyl]-N-propyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-[4-chloro-3-(trifluoromethyl)phenyl]-N-propyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-[4-chloro-3-(trifluoromethyl)phenyl]-N-propyl-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-[4-chloro-3-(trifluoromethyl)phenyl]-N-propylpyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-[4-chloro-3-(trifluoromethyl)phenyl]-N-propyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C21H17ClF3N5O MolecularWeight: 447.84079

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)Cl)C(F)(F)F)N

Isomeric SMILES

CCCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)Cl)C(F)(F)F)N

InChI

InChI=1S/C21H17ClF3N5O/c1-2-9-27-20(31)16-17-19(29-15-6-4-3-5-14(15)28-17)30(18(16)26)11-7-8-13(22)12(10-11)21(23,24)25/h3-8,10H,2,9,26H2,1H3,(H,27,31)