3-[[3-fluoranyl-2-(methylsulfamoylamino)pyridin-4-yl]methyl]-6-iodanyl-4-methyl-7-pyrimidin-2-yloxy-chromen-2-one

Systemtic Name: 3-[[3-fluoranyl-2-(methylsulfamoylamino)pyridin-4-yl]methyl]-6-iodanyl-4-methyl-7-pyrimidin-2-yloxy-chromen-2-one Openeye Name: 3-[[3-fluoro-2-(methylsulfamoylamino)-4-pyridyl]methyl]-6-iodo-4-methyl-7-pyrimidin-2-yloxy-chromen-2-one CAS Name: 3-[[3-fluoro-2-(methylsulfamoylamino)-4-pyridinyl]methyl]-6-iodo-4-methyl-7-(2-pyrimidinyloxy)-1-benzopyran-2-one IUPAC Name: 3-[[3-fluoro-2-(methylsulfamoylamino)pyridin-4-yl]methyl]-6-iodo-4-methyl-7-pyrimidin-2-yloxychromen-2-one Traditional Name: 3-[[3-fluoro-2-(methylsulfamoylamino)-4-pyridyl]methyl]-6-iodo-4-methyl-7-(2-pyrimidyloxy)coumarin Formula: C21H17FIN5O5S MolecularWeight: 597.358053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)I)OC3=NC=CC=N3)CC4=C(C(=NC=C4)NS(=O)(=O)NC)F

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)I)OC3=NC=CC=N3)CC4=C(C(=NC=C4)NS(=O)(=O)NC)F

InChI

InChI=1S/C21H17FIN5O5S/c1-11-13-9-15(23)17(33-21-26-5-3-6-27-21)10-16(13)32-20(29)14(11)8-12-4-7-25-19(18(12)22)28-34(30,31)24-2/h3-7,9-10,24H,8H2,1-2H3,(H,25,28)