2-[5-[4-[[3-azanyl-1-(4-carboxy-1,3-thiazol-2-yl)-3-oxidanylidene-propyl]carbamoyl]-5-methyl-1,3-oxazol-2-yl]-6-[2-[2-(3-methyl-2,3-dihydro-1H-pyrrol-2-yl)-1,3-thiazol-4-yl]-1,3-thiazol-4-yl]pyridin-2-yl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[5-[4-[[3-azanyl-1-(4-carboxy-1,3-thiazol-2-yl)-3-oxidanylidene-propyl]carbamoyl]-5-methyl-1,3-oxazol-2-yl]-6-[2-[2-(3-methyl-2,3-dihydro-1H-pyrrol-2-yl)-1,3-thiazol-4-yl]-1,3-thiazol-4-yl]pyridin-2-yl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[5-[4-[[3-amino-1-(4-carboxythiazol-2-yl)-3-oxo-propyl]carbamoyl]-5-methyl-oxazol-2-yl]-6-[2-[2-(3-methyl-2,3-dihydro-1H-pyrrol-2-yl)thiazol-4-yl]thiazol-4-yl]-2-pyridyl]thiazole-4-carboxylic acid CAS Name: 2-[5-[4-[[[3-amino-1-(4-carboxy-2-thiazolyl)-3-oxopropyl]amino]-oxomethyl]-5-methyl-2-oxazolyl]-6-[2-[2-(3-methyl-2,3-dihydro-1H-pyrrol-2-yl)-4-thiazolyl]-4-thiazolyl]-2-pyridinyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[5-[4-[[3-amino-1-(4-carboxy-1,3-thiazol-2-yl)-3-oxopropyl]carbamoyl]-5-methyl-1,3-oxazol-2-yl]-6-[2-[2-(3-methyl-2,3-dihydro-1H-pyrrol-2-yl)-1,3-thiazol-4-yl]-1,3-thiazol-4-yl]pyridin-2-yl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[5-[4-[[3-amino-1-(4-carboxythiazol-2-yl)-3-keto-propyl]carbamoyl]-5-methyl-oxazol-2-yl]-6-[2-[2-(3-methyl-2-pyrrolin-2-yl)thiazol-4-yl]thiazol-4-yl]-2-pyridyl]thiazole-4-carboxylic acid Formula: C32H25N9O7S4 MolecularWeight: 775.857

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CNC1C2=NC(=CS2)C3=NC(=CS3)C4=C(C=CC(=N4)C5=NC(=CS5)C(=O)O)C6=NC(=C(O6)C)C(=O)NC(CC(=O)N)C7=NC(=CS7)C(=O)O

Isomeric SMILES

CC1C=CNC1C2=NC(=CS2)C3=NC(=CS3)C4=C(C=CC(=N4)C5=NC(=CS5)C(=O)O)C6=NC(=C(O6)C)C(=O)NC(CC(=O)N)C7=NC(=CS7)C(=O)O

InChI

InChI=1S/C32H25N9O7S4/c1-12-5-6-34-22(12)30-38-18(9-52-30)29-37-17(8-49-29)24-14(3-4-15(35-24)27-39-19(10-50-27)31(44)45)26-41-23(13(2)48-26)25(43)36-16(7-21(33)42)28-40-20(11-51-28)32(46)47/h3-6,8-12,16,22,34H,7H2,1-2H3,(H2,33,42)(H,36,43)(H,44,45)(H,46,47)