COc1c(Br)cc(-n2ccc(=O)[nH]c2=O)cc1-c1ccc2c(c1)CC=C2CCS(N)(=O)=O

Название: product

IUPAC: 2-[5-[3-bromo-5-(2,4-dioxopyrimidin-1-yl)-2-methoxyphenyl]-3H-inden-1-yl]ethanesulfonamide

SMILES: COc1c(Br)cc(-n2ccc(=O)[nH]c2=O)cc1-c1ccc2c(c1)CC=C2CCS(N)(=O)=O

Canonical SMILES: COC1=C(C=C(C=C1Br)N2C=CC(=O)NC2=O)C3=CC4=C(C=C3)C(=CC4)CCS(=O)(=O)N

Молекулярная формула: C22H20BrN3O5S

Молекулярная масса: 518.40

InChIKey: MKHBNHYYLKEMPS-UHFFFAOYSA-N

InChI:

InChI=1S/C22H20BrN3O5S/c1-31-21-18(11-16(12-19(21)23)26-8-6-20(27)25-22(26)28)15-4-5-17-13(2-3-14(17)10-15)7-9-32(24,29)30/h2,4-6,8,10-12H,3,7,9H2,1H3,(H2,24,29,30)(H,25,27,28)

PubChem CID: 131730746 →

Синонимы

MKHBNHYYLKEMPS-UHFFFAOYSA-N((6-(3-bromo-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2-methoxyphenyl)-1H-inden-3-yl)methyl)methanesulfonamide

Участвует в 3 реакциях→