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

Systemtic Name: N-[2-[bis(azanyl)methylideneamino]oxyethyl]-2-[3-(2,2-diphenylpropylamino)-6-methyl-2-oxidanylidene-pyrazin-1-yl]ethanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-[3-(2,2-diphenylpropylamino)-6-methyl-2-oxo-pyrazin-1-yl]-N-(2-guanidinooxyethyl)acetamide; 2,2,2-trifluoroacetic acid CAS Name: N-[2-(diaminomethylideneamino)oxyethyl]-2-[3-(2,2-diphenylpropylamino)-6-methyl-2-oxo-1-pyrazinyl]acetamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-[2-(diaminomethylideneamino)oxyethyl]-2-[3-(2,2-diphenylpropylamino)-6-methyl-2-oxopyrazin-1-yl]acetamide; 2,2,2-trifluoroacetic acid Traditional Name: 2-[3-(2,2-diphenylpropylamino)-2-keto-6-methyl-pyrazin-1-yl]-N-(2-guanidinooxyethyl)acetamide; 2,2,2-trifluoroacetic acid Formula: C27H32F3N7O5 MolecularWeight: 591.58209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=O)N1CC(=O)NCCON=C(N)N)NCC(C)(C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=CN=C(C(=O)N1CC(=O)NCCON=C(N)N)NCC(C)(C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C25H31N7O3.C2HF3O2/c1-18-15-29-22(23(34)32(18)16-21(33)28-13-14-35-31-24(26)27)30-17-25(2,19-9-5-3-6-10-19)20-11-7-4-8-12-20;3-2(4,5)1(6)7/h3-12,15H,13-14,16-17H2,1-2H3,(H,28,33)(H,29,30)(H4,26,27,31);(H,6,7)