3-(3-nitrophenyl)-3-[(1-thiophen-2-ylcarbonyl-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl)carbonylamino]propanoic acid

Systemtic Name: 3-(3-nitrophenyl)-3-[(1-thiophen-2-ylcarbonyl-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl)carbonylamino]propanoic acid Openeye Name: 3-(3-nitrophenyl)-3-[[1-(2-thienylsulfonyl)-3-(thiophene-2-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-(3-nitrophenyl)-3-[[oxo-[1-[oxo(thiophen-2-yl)methyl]-3-thiophen-2-ylsulfonyl-2-imidazolidinyl]methyl]amino]propanoic acid IUPAC Name: 3-(3-nitrophenyl)-3-[[1-(thiophene-2-carbonyl)-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-(3-nitrophenyl)-3-[[1-(2-thenoyl)-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C22H20N4O8S3 MolecularWeight: 564.6112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N1C(=O)C2=CC=CS2)C(=O)NC(CC(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(C(N1C(=O)C2=CC=CS2)C(=O)NC(CC(=O)O)C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H20N4O8S3/c27-18(28)13-16(14-4-1-5-15(12-14)26(31)32)23-20(29)21-24(22(30)17-6-2-10-35-17)8-9-25(21)37(33,34)19-7-3-11-36-19/h1-7,10-12,16,21H,8-9,13H2,(H,23,29)(H,27,28)