N-[(2S)-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]-2-[3-[(2-methylphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]ethanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-[(2S)-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]-2-[3-[(2-methylphenyl)sulfonylamino]-2-oxidanylidene-pyridin-1-yl]ethanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-[(1S)-1-formyl-4-guanidino-butyl]-2-[3-(o-tolylsulfonylamino)-2-oxo-1-pyridyl]acetamide; 2,2,2-trifluoroacetic acid CAS Name: N-[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-2-[3-[(2-methylphenyl)sulfonylamino]-2-oxo-1-pyridinyl]acetamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-[(2S)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-2-[3-[(2-methylphenyl)sulfonylamino]-2-oxopyridin-1-yl]acetamide; 2,2,2-trifluoroacetic acid Traditional Name: N-[(1S)-1-formyl-4-guanidino-butyl]-2-[2-keto-3-(o-tolylsulfonylamino)-1-pyridyl]acetamide; 2,2,2-trifluoroacetic acid Formula: C22H27F3N6O7S MolecularWeight: 576.54599

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC2=CC=CN(C2=O)CC(=O)NC(CCCN=C(N)N)C=O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC2=CC=CN(C2=O)CC(=O)N[C@@H](CCCN=C(N)N)C=O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C20H26N6O5S.C2HF3O2/c1-14-6-2-3-9-17(14)32(30,31)25-16-8-5-11-26(19(16)29)12-18(28)24-15(13-27)7-4-10-23-20(21)22;3-2(4,5)1(6)7/h2-3,5-6,8-9,11,13,15,25H,4,7,10,12H2,1H3,(H,24,28)(H4,21,22,23);(H,6,7)/t15-;/m0./s1