dimethyl-[3-[[2-oxidanylidene-2-[(1-thiophen-2-ylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)amino]ethanoyl]amino]propyl]azanium

Systemtic Name: dimethyl-[3-[[2-oxidanylidene-2-[(1-thiophen-2-ylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)amino]ethanoyl]amino]propyl]azanium Openeye Name: dimethyl-[3-[[2-oxo-2-[[1-(2-thienylsulfonyl)-3,4-dihydro-2H-quinolin-7-yl]amino]acetyl]amino]propyl]ammonium CAS Name: 3-[[1,2-dioxo-2-[(1-thiophen-2-ylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)amino]ethyl]amino]propyl-dimethylammonium IUPAC Name: dimethyl-[3-[[2-oxo-2-[(1-thiophen-2-ylsulfonyl-3,4-dihydro-2H-quinolin-7-yl)amino]acetyl]amino]propyl]azanium Traditional Name: 3-[[2-keto-2-[[1-(2-thienylsulfonyl)-3,4-dihydro-2H-quinolin-7-yl]amino]acetyl]amino]propyl-dimethyl-ammonium Formula: C20H27N4O4S2+ MolecularWeight: 451.58278

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C(=O)NC1=CC2=C(CCCN2S(=O)(=O)C3=CC=CS3)C=C1

Isomeric SMILES

C[NH+](C)CCCNC(=O)C(=O)NC1=CC2=C(CCCN2S(=O)(=O)C3=CC=CS3)C=C1

InChI

InChI=1S/C20H26N4O4S2/c1-23(2)11-5-10-21-19(25)20(26)22-16-9-8-15-6-3-12-24(17(15)14-16)30(27,28)18-7-4-13-29-18/h4,7-9,13-14H,3,5-6,10-12H2,1-2H3,(H,21,25)(H,22,26)/p+1