[[2-bromanyl-4-[[(3,4-dichlorophenyl)-[4-[4-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]phenyl]-1,3-thiazol-2-yl]amino]methyl]phenyl]-bis(fluoranyl)methyl]phosphonic acid

Systemtic Name: [[2-bromanyl-4-[[(3,4-dichlorophenyl)-[4-[4-[(2-ethoxy-2-oxidanylidene-ethanoyl)amino]phenyl]-1,3-thiazol-2-yl]amino]methyl]phenyl]-bis(fluoranyl)methyl]phosphonic acid Openeye Name: [[2-bromo-4-[(3,4-dichloro-N-[4-[4-[(2-ethoxy-2-oxo-acetyl)amino]phenyl]thiazol-2-yl]anilino)methyl]phenyl]-difluoro-methyl]phosphonic acid CAS Name: [[2-bromo-4-[(3,4-dichloro-N-[4-[4-[(2-ethoxy-1,2-dioxoethyl)amino]phenyl]-2-thiazolyl]anilino)methyl]phenyl]-difluoromethyl]phosphonic acid IUPAC Name: [[2-bromo-4-[(3,4-dichloro-N-[4-[4-[(2-ethoxy-2-oxoacetyl)amino]phenyl]-1,3-thiazol-2-yl]anilino)methyl]phenyl]-difluoromethyl]phosphonic acid Traditional Name: [[2-bromo-4-[(3,4-dichloro-N-[4-[4-(ethoxalylamino)phenyl]thiazol-2-yl]anilino)methyl]phenyl]-difluoro-methyl]phosphonic acid Formula: C27H21BrCl2F2N3O6PS MolecularWeight: 735.317707

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)NC1=CC=C(C=C1)C2=CSC(=N2)N(CC3=CC(=C(C=C3)C(F)(F)P(=O)(O)O)Br)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CCOC(=O)C(=O)NC1=CC=C(C=C1)C2=CSC(=N2)N(CC3=CC(=C(C=C3)C(F)(F)P(=O)(O)O)Br)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C27H21BrCl2F2N3O6PS/c1-2-41-25(37)24(36)33-17-6-4-16(5-7-17)23-14-43-26(34-23)35(18-8-10-21(29)22(30)12-18)13-15-3-9-19(20(28)11-15)27(31,32)42(38,39)40/h3-12,14H,2,13H2,1H3,(H,33,36)(H2,38,39,40)