2-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-6-methyl-2-oxidanylidene-pyrazin-1-yl]-N-[2-[bis(azanyl)methylideneamino]oxyethyl]ethanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-6-methyl-2-oxidanylidene-pyrazin-1-yl]-N-[2-[bis(azanyl)methylideneamino]oxyethyl]ethanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-6-methyl-2-oxo-pyrazin-1-yl]-N-(2-guanidinooxyethyl)acetamide; 2,2,2-trifluoroacetic acid CAS Name: 2-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-6-methyl-2-oxo-1-pyrazinyl]-N-[2-(diaminomethylideneamino)oxyethyl]acetamide; 2,2,2-trifluoroacetic acid IUPAC Name: 2-[3-[2-(1,3-benzodioxol-5-yl)ethylamino]-6-methyl-2-oxopyrazin-1-yl]-N-[2-(diaminomethylideneamino)oxyethyl]acetamide; 2,2,2-trifluoroacetic acid Traditional Name: N-(2-guanidinooxyethyl)-2-[3-(homopiperonylamino)-2-keto-6-methyl-pyrazin-1-yl]acetamide; 2,2,2-trifluoroacetic acid Formula: C21H26F3N7O7 MolecularWeight: 545.46905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=O)N1CC(=O)NCCON=C(N)N)NCCC2=CC3=C(C=C2)OCO3.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=CN=C(C(=O)N1CC(=O)NCCON=C(N)N)NCCC2=CC3=C(C=C2)OCO3.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C19H25N7O5.C2HF3O2/c1-12-9-24-17(23-5-4-13-2-3-14-15(8-13)30-11-29-14)18(28)26(12)10-16(27)22-6-7-31-25-19(20)21;3-2(4,5)1(6)7/h2-3,8-9H,4-7,10-11H2,1H3,(H,22,27)(H,23,24)(H4,20,21,25);(H,6,7)