2-chloranyl-5-[5-[(6-methoxycarbonyl-7-methyl-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]furan-2-yl]benzoic acid

Systemtic Name: 2-chloranyl-5-[5-[(6-methoxycarbonyl-7-methyl-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]furan-2-yl]benzoic acid Openeye Name: 2-chloro-5-[5-[(6-methoxycarbonyl-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]-2-furyl]benzoic acid CAS Name: 2-chloro-5-[5-[(6-methoxycarbonyl-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]-2-furanyl]benzoic acid IUPAC Name: 2-chloro-5-[5-[(6-methoxycarbonyl-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]furan-2-yl]benzoic acid Traditional Name: 5-[5-[(6-carbomethoxy-3-keto-7-methyl-5-phenyl-5H-thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]-2-furyl]-2-chloro-benzoic acid Formula: C27H19ClN2O6S MolecularWeight: 534.96756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Cl)C(=O)O)SC2=N1)C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Cl)C(=O)O)SC2=N1)C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C27H19ClN2O6S/c1-14-22(26(34)35-2)23(15-6-4-3-5-7-15)30-24(31)21(37-27(30)29-14)13-17-9-11-20(36-17)16-8-10-19(28)18(12-16)25(32)33/h3-13,23H,1-2H3,(H,32,33)