N-(2-azanylethyl)-1-(3-bromanyl-5-tert-butyl-2-oxidanyl-phenyl)-2-chloranyl-5-methyl-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-methyl-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-methyl-N-[2-(methylamino)ethyl]-2H-pyrazine-6-carboxamide CAS Name: N-(2-aminoethyl)-1-(3-bromo-5-tert-butyl-2-hydroxyphenyl)-2-chloro-5-methyl-N-[2-(methylamino)ethyl]-2H-pyrazine-6-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(3-bromo-5-tert-butyl-2-hydroxyphenyl)-2-chloro-5-methyl-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-methyl-N-[2-(methylamino)ethyl]-2H-pyrazine-6-carboxamide Formula: C21H31BrClN5O2 MolecularWeight: 500.86014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(C=N1)Cl)C2=C(C(=CC(=C2)C(C)(C)C)Br)O)C(=O)N(CCN)CCNC

Isomeric SMILES

CC1=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/C21H31BrClN5O2/c1-13-18(20(30)27(8-6-24)9-7-25-5)28(17(23)12-26-13)16-11-14(21(2,3)4)10-15(22)19(16)29/h10-12,17,25,29H,6-9,24H2,1-5H3