N-(2-azanylethyl)-1-(3-bromanyl-5-tert-butyl-2-oxidanyl-phenyl)-2-chloranyl-5-ethyl-N-[2-(methylamino)ethyl]-2H-pyrazine-6-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(3-bromanyl-5-tert-butyl-2-oxidanyl-phenyl)-2-chloranyl-5-ethyl-N-[2-(methylamino)ethyl]-2H-pyrazine-6-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3-bromo-5-tert-butyl-2-hydroxy-phenyl)-2-chloro-5-ethyl-N-[2-(methylamino)ethyl]-2H-pyrazine-6-carboxamide CAS Name: N-(2-aminoethyl)-1-(3-bromo-5-tert-butyl-2-hydroxyphenyl)-2-chloro-5-ethyl-N-[2-(methylamino)ethyl]-2H-pyrazine-6-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(3-bromo-5-tert-butyl-2-hydroxyphenyl)-2-chloro-5-ethyl-N-[2-(methylamino)ethyl]-2H-pyrazine-6-carboxamide Traditional Name: N-(2-aminoethyl)-1-(3-bromo-5-tert-butyl-2-hydroxy-phenyl)-2-chloro-5-ethyl-N-[2-(methylamino)ethyl]-2H-pyrazine-6-carboxamide Formula: C22H33BrClN5O2 MolecularWeight: 514.88672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(C=N1)Cl)C2=C(C(=CC(=C2)C(C)(C)C)Br)O)C(=O)N(CCN)CCNC

Isomeric SMILES

CCC1=C(N(C(C=N1)Cl)C2=C(C(=CC(=C2)C(C)(C)C)Br)O)C(=O)N(CCN)CCNC

InChI

InChI=1S/C22H33BrClN5O2/c1-6-16-19(21(31)28(9-7-25)10-8-26-5)29(18(24)13-27-16)17-12-14(22(2,3)4)11-15(23)20(17)30/h11-13,18,26,30H,6-10,25H2,1-5H3