N-[1-[3,4-bis(fluoranyl)-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]phenyl]carbonylazetidin-3-yl]-3-[bis(2-hydroxyethyl)amino]propanamide

Systemtic Name: N-[1-[3,4-bis(fluoranyl)-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]phenyl]carbonylazetidin-3-yl]-3-[bis(2-hydroxyethyl)amino]propanamide Openeye Name: 3-[bis(2-hydroxyethyl)amino]-N-[1-[3,4-difluoro-2-(2-fluoro-4-iodo-anilino)benzoyl]azetidin-3-yl]propanamide CAS Name: 3-[bis(2-hydroxyethyl)amino]-N-[1-[[3,4-difluoro-2-(2-fluoro-4-iodoanilino)phenyl]-oxomethyl]-3-azetidinyl]propanamide IUPAC Name: 3-[bis(2-hydroxyethyl)amino]-N-[1-[3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzoyl]azetidin-3-yl]propanamide Traditional Name: 3-[bis(2-hydroxyethyl)amino]-N-[1-[3,4-difluoro-2-(2-fluoro-4-iodo-anilino)benzoyl]azetidin-3-yl]propionamide Formula: C23H26F3IN4O4 MolecularWeight: 606.37662

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C(=O)C2=C(C(=C(C=C2)F)F)NC3=C(C=C(C=C3)I)F)NC(=O)CCN(CCO)CCO

Isomeric SMILES

C1C(CN1C(=O)C2=C(C(=C(C=C2)F)F)NC3=C(C=C(C=C3)I)F)NC(=O)CCN(CCO)CCO

InChI

InChI=1S/C23H26F3IN4O4/c24-17-3-2-16(22(21(17)26)29-19-4-1-14(27)11-18(19)25)23(35)31-12-15(13-31)28-20(34)5-6-30(7-9-32)8-10-33/h1-4,11,15,29,32-33H,5-10,12-13H2,(H,28,34)