3-[[2-[(3-ethoxycarbonyl-5-methyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]azaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[[2-[(3-ethoxycarbonyl-5-methyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]azaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[2-[(3-ethoxycarbonyl-5-methyl-4-phenyl-2-thienyl)amino]-2-oxo-ethyl]ammonio]propyl-diethyl-ammonium CAS Name: 3-[[2-[(3-ethoxycarbonyl-5-methyl-4-phenyl-2-thiophenyl)amino]-2-oxoethyl]ammonio]propyl-diethylammonium IUPAC Name: 3-[[2-[(3-ethoxycarbonyl-5-methyl-4-phenylthiophen-2-yl)amino]-2-oxoethyl]azaniumyl]propyl-diethylazanium Traditional Name: 3-[[2-[(3-carbethoxy-5-methyl-4-phenyl-2-thienyl)amino]-2-keto-ethyl]ammonio]propyl-diethyl-ammonium Formula: C23H35N3O3S+2 MolecularWeight: 433.6073

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC(=O)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC(=O)NC1=C(C(=C(S1)C)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C23H33N3O3S/c1-5-26(6-2)15-11-14-24-16-19(27)25-22-21(23(28)29-7-3)20(17(4)30-22)18-12-9-8-10-13-18/h8-10,12-13,24H,5-7,11,14-16H2,1-4H3,(H,25,27)/p+2