N1-[(1,5-dimethylpyrrol-2-yl)methyl]-N4,N4-diethyl-benzene-1,4-disulfonamide

Systemtic Name: N1-[(1,5-dimethylpyrrol-2-yl)methyl]-N4,N4-diethyl-benzene-1,4-disulfonamide Openeye Name: N1-[(1,5-dimethylpyrrol-2-yl)methyl]-N4,N4-diethyl-benzene-1,4-disulfonamide CAS Name: N1-[(1,5-dimethyl-2-pyrrolyl)methyl]-N4,N4-diethylbenzene-1,4-disulfonamide IUPAC Name: 1-N-[(1,5-dimethylpyrrol-2-yl)methyl]-4-N,4-N-diethylbenzene-1,4-disulfonamide Traditional Name: N-[(1,5-dimethylpyrrol-2-yl)methyl]-N',N'-diethyl-benzene-1,4-disulfonamide Formula: C17H25N3O4S2 MolecularWeight: 399.5281

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(N2C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(N2C)C

InChI

InChI=1S/C17H25N3O4S2/c1-5-20(6-2)26(23,24)17-11-9-16(10-12-17)25(21,22)18-13-15-8-7-14(3)19(15)4/h7-12,18H,5-6,13H2,1-4H3