3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-methylsulfonyl-amino]-5-fluoranyl-N-pyrimidin-2-yl-benzamide

Systemtic Name: 3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-methylsulfonyl-amino]-5-fluoranyl-N-pyrimidin-2-yl-benzamide Openeye Name: 3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-methylsulfonyl-amino]-5-fluoro-N-pyrimidin-2-yl-benzamide CAS Name: 3-[[1-[bis(4-chlorophenyl)methyl]-3-azetidinyl]-methylsulfonylamino]-5-fluoro-N-(2-pyrimidinyl)benzamide IUPAC Name: 3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-methylsulfonylamino]-5-fluoro-N-pyrimidin-2-ylbenzamide Traditional Name: 3-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-mesyl-amino]-5-fluoro-N-(2-pyrimidyl)benzamide Formula: C28H24Cl2FN5O3S MolecularWeight: 600.491263

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1CN(C1)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC(=CC(=C4)C(=O)NC5=NC=CC=N5)F

Isomeric SMILES

CS(=O)(=O)N(C1CN(C1)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC(=CC(=C4)C(=O)NC5=NC=CC=N5)F

InChI

InChI=1S/C28H24Cl2FN5O3S/c1-40(38,39)36(24-14-20(13-23(31)15-24)27(37)34-28-32-11-2-12-33-28)25-16-35(17-25)26(18-3-7-21(29)8-4-18)19-5-9-22(30)10-6-19/h2-15,25-26H,16-17H2,1H3,(H,32,33,34,37)