methyl 5-aminocarbonyl-4-methyl-2-[[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethanoyl]amino]thiophene-3-carboxylate

Systemtic Name: methyl 5-aminocarbonyl-4-methyl-2-[[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethanoyl]amino]thiophene-3-carboxylate Openeye Name: methyl 5-carbamoyl-4-methyl-2-[[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-acetyl]amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[2-(4-methyl-1-piperazin-4-iumyl)-1,2-dioxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-carbamoyl-4-methyl-2-[[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[[2-keto-2-(4-methylpiperazin-4-ium-1-yl)acetyl]amino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C15H21N4O5S+ MolecularWeight: 369.41604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C(=O)N2CC[NH+](CC2)C)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C(=O)N2CC[NH+](CC2)C)C(=O)N

InChI

InChI=1S/C15H20N4O5S/c1-8-9(15(23)24-3)13(25-10(8)11(16)20)17-12(21)14(22)19-6-4-18(2)5-7-19/h4-7H2,1-3H3,(H2,16,20)(H,17,21)/p+1