[2-[[5-aminocarbonyl-3-(2-methoxyethoxycarbonyl)-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]azanium

Systemtic Name: [2-[[5-aminocarbonyl-3-(2-methoxyethoxycarbonyl)-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]azanium Openeye Name: [2-[[5-carbamoyl-3-(2-methoxyethoxycarbonyl)-4-methyl-2-thienyl]amino]-2-oxo-ethyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ammonium CAS Name: [2-[[5-carbamoyl-3-[2-methoxyethoxy(oxo)methyl]-4-methyl-2-thiophenyl]amino]-2-oxoethyl]-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]ammonium IUPAC Name: [2-[[5-carbamoyl-3-(2-methoxyethoxycarbonyl)-4-methylthiophen-2-yl]amino]-2-oxoethyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]azanium Traditional Name: [2-[[5-carbamoyl-3-(2-methoxyethoxycarbonyl)-4-methyl-2-thienyl]amino]-2-keto-ethyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ammonium Formula: C19H32N4O5S+2 MolecularWeight: 428.54618

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1C[NH2+]CC(=O)NC2=C(C(=C(S2)C(=O)N)C)C(=O)OCCOC

Isomeric SMILES

CC[NH+]1CCC[C@H]1C[NH2+]CC(=O)NC2=C(C(=C(S2)C(=O)N)C)C(=O)OCCOC

InChI

InChI=1S/C19H30N4O5S/c1-4-23-7-5-6-13(23)10-21-11-14(24)22-18-15(19(26)28-9-8-27-3)12(2)16(29-18)17(20)25/h13,21H,4-11H2,1-3H3,(H2,20,25)(H,22,24)/p+2/t13-/m0/s1