4-[[2-[4-[chloranyl-bis(fluoranyl)methoxy]phenyl]imino-4-oxidanylidene-3-(phenylmethyl)-1,3-thiazinan-6-yl]carbonylamino]benzoic acid

Systemtic Name: 4-[[2-[4-[chloranyl-bis(fluoranyl)methoxy]phenyl]imino-4-oxidanylidene-3-(phenylmethyl)-1,3-thiazinan-6-yl]carbonylamino]benzoic acid Openeye Name: 4-[[3-benzyl-2-[4-[chloro(difluoro)methoxy]phenyl]imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid CAS Name: 4-[[[2-[4-[chloro(difluoro)methoxy]phenyl]imino-4-oxo-3-(phenylmethyl)-1,3-thiazinan-6-yl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[3-benzyl-2-[4-[chloro(difluoro)methoxy]phenyl]imino-4-oxo-1,3-thiazinane-6-carbonyl]amino]benzoic acid Traditional Name: 4-[[3-benzyl-2-[4-[chloro(difluoro)methoxy]phenyl]imino-4-keto-1,3-thiazinane-6-carbonyl]amino]benzoic acid Formula: C26H20ClF2N3O5S MolecularWeight: 559.968906

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC(=NC2=CC=C(C=C2)OC(F)(F)Cl)N(C1=O)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1C(SC(=NC2=CC=C(C=C2)OC(F)(F)Cl)N(C1=O)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C26H20ClF2N3O5S/c27-26(28,29)37-20-12-10-19(11-13-20)31-25-32(15-16-4-2-1-3-5-16)22(33)14-21(38-25)23(34)30-18-8-6-17(7-9-18)24(35)36/h1-13,21H,14-15H2,(H,30,34)(H,35,36)