N-[6-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(4-methylphenyl)pyrimidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[6-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-5-(4-methylphenyl)pyrimidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(p-tolyl)pyrimidin-4-yl]thiophene-2-sulfonamide CAS Name: N-[6-[2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy]-5-(4-methylphenyl)-4-pyrimidinyl]-2-thiophenesulfonamide IUPAC Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(4-methylphenyl)pyrimidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-5-(p-tolyl)pyrimidin-4-yl]thiophene-2-sulfonamide Formula: C21H18BrN5O4S2 MolecularWeight: 548.43272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=CN=C2OCCOC3=NC=C(C=N3)Br)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=CN=C2OCCOC3=NC=C(C=N3)Br)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H18BrN5O4S2/c1-14-4-6-15(7-5-14)18-19(27-33(28,29)17-3-2-10-32-17)25-13-26-20(18)30-8-9-31-21-23-11-16(22)12-24-21/h2-7,10-13H,8-9H2,1H3,(H,25,26,27)