5-azanyl-N,N-dimethyl-4-sulfanyl-3,4-dihydro-2H-pyrrole-2-carboxamide; tris(fluoranyl)methanesulfonic acid

Systemtic Name: 5-azanyl-N,N-dimethyl-4-sulfanyl-3,4-dihydro-2H-pyrrole-2-carboxamide; tris(fluoranyl)methanesulfonic acid Openeye Name: 5-amino-N,N-dimethyl-4-sulfanyl-3,4-dihydro-2H-pyrrole-2-carboxamide; trifluoromethanesulfonic acid CAS Name: 5-amino-4-mercapto-N,N-dimethyl-3,4-dihydro-2H-pyrrole-2-carboxamide; trifluoromethanesulfonic acid IUPAC Name: 5-amino-N,N-dimethyl-4-sulfanyl-3,4-dihydro-2H-pyrrole-2-carboxamide; trifluoromethanesulfonic acid Traditional Name: 5-amino-4-mercapto-N,N-dimethyl-1-pyrroline-2-carboxamide; triflic acid Formula: C8H14F3N3O4S2 MolecularWeight: 337.33967

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CC(C(=N1)N)S.C(F)(F)(F)S(=O)(=O)O

Isomeric SMILES

CN(C)C(=O)C1CC(C(=N1)N)S.C(F)(F)(F)S(=O)(=O)O

InChI

InChI=1S/C7H13N3OS.CHF3O3S/c1-10(2)7(11)4-3-5(12)6(8)9-4;2-1(3,4)8(5,6)7/h4-5,12H,3H2,1-2H3,(H2,8,9);(H,5,6,7)