N-(2-azanyl-3-heptan-4-ylsulfonyl-propanoyl)-5-methyl-1H-pyrazole-3-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-(2-azanyl-3-heptan-4-ylsulfonyl-propanoyl)-5-methyl-1H-pyrazole-3-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-[2-amino-3-(1-propylbutylsulfonyl)propanoyl]-5-methyl-1H-pyrazole-3-carboxamide; 2,2,2-trifluoroacetic acid CAS Name: N-(2-amino-3-heptan-4-ylsulfonyl-1-oxopropyl)-5-methyl-1H-pyrazole-3-carboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-(2-amino-3-heptan-4-ylsulfonylpropanoyl)-5-methyl-1H-pyrazole-3-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: N-[2-amino-3-(1-propylbutylsulfonyl)propanoyl]-5-methyl-1H-pyrazole-3-carboxamide; 2,2,2-trifluoroacetic acid Formula: C17H27F3N4O6S MolecularWeight: 472.47969

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(=O)C1=NNC(=C1)C)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(=O)C1=NNC(=C1)C)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C15H26N4O4S.C2HF3O2/c1-4-6-11(7-5-2)24(22,23)9-12(16)14(20)17-15(21)13-8-10(3)18-19-13;3-2(4,5)1(6)7/h8,11-12H,4-7,9,16H2,1-3H3,(H,18,19)(H,17,20,21);(H,6,7)