2-[3-(carboxymethyl)-2-[2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]phenyl]imino-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoic acid

Systemtic Name: 2-[3-(carboxymethyl)-2-[2-chloranyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]phenyl]imino-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoic acid Openeye Name: 2-[3-(carboxymethyl)-2-[2-chloro-4-fluoro-5-(3-methyl-2,6-dioxo-pyrimidin-1-yl)phenyl]imino-4-oxo-thiazolidin-5-yl]acetic acid CAS Name: 2-[3-(carboxymethyl)-2-[2-chloro-4-fluoro-5-(3-methyl-2,6-dioxo-1-pyrimidinyl)phenyl]imino-4-oxo-5-thiazolidinyl]acetic acid IUPAC Name: 2-[3-(carboxymethyl)-2-[2-chloro-4-fluoro-5-(3-methyl-2,6-dioxopyrimidin-1-yl)phenyl]imino-4-oxo-1,3-thiazolidin-5-yl]acetic acid Traditional Name: 2-[3-(carboxymethyl)-2-[2-chloro-5-(2,6-diketo-3-methyl-pyrimidin-1-yl)-4-fluoro-phenyl]imino-4-keto-thiazolidin-5-yl]acetic acid Formula: C18H14ClFN4O7S MolecularWeight: 484.842763

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=O)N(C1=O)C2=C(C=C(C(=C2)N=C3N(C(=O)C(S3)CC(=O)O)CC(=O)O)Cl)F

Isomeric SMILES

CN1C=CC(=O)N(C1=O)C2=C(C=C(C(=C2)N=C3N(C(=O)C(S3)CC(=O)O)CC(=O)O)Cl)F

InChI

InChI=1S/C18H14ClFN4O7S/c1-22-3-2-13(25)24(18(22)31)11-5-10(8(19)4-9(11)20)21-17-23(7-15(28)29)16(30)12(32-17)6-14(26)27/h2-5,12H,6-7H2,1H3,(H,26,27)(H,28,29)