[2-[(3-aminocarbonyl-5-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]azanium

Systemtic Name: [2-[(3-aminocarbonyl-5-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]azanium Openeye Name: [2-[(3-carbamoyl-5-phenyl-2-thienyl)amino]-2-oxo-ethyl]-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ammonium CAS Name: [2-[(3-carbamoyl-5-phenyl-2-thiophenyl)amino]-2-oxoethyl]-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]ammonium IUPAC Name: [2-[(3-carbamoyl-5-phenylthiophen-2-yl)amino]-2-oxoethyl]-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]azanium Traditional Name: [2-[(3-carbamoyl-5-phenyl-2-thienyl)amino]-2-keto-ethyl]-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ammonium Formula: C20H28N4O2S+2 MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1C[NH2+]CC(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC[NH+]1CCC[C@@H]1C[NH2+]CC(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C20H26N4O2S/c1-2-24-10-6-9-15(24)12-22-13-18(25)23-20-16(19(21)26)11-17(27-20)14-7-4-3-5-8-14/h3-5,7-8,11,15,22H,2,6,9-10,12-13H2,1H3,(H2,21,26)(H,23,25)/p+2/t15-/m1/s1