4-[(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-methoxyethyl)benzenesulfonamide

Systemtic Name: 4-[(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-methoxyethyl)benzenesulfonamide Openeye Name: 4-[(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-methoxyethyl)benzenesulfonamide CAS Name: 4-[(3-bromo-5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)amino]-N-(2-methoxyethyl)benzenesulfonamide IUPAC Name: 4-[(3-bromo-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-methoxyethyl)benzenesulfonamide Traditional Name: 4-[(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-methoxyethyl)benzenesulfonamide Formula: C21H20BrN5O3S MolecularWeight: 502.3842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4

Isomeric SMILES

COCCNS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4

InChI

InChI=1S/C21H20BrN5O3S/c1-30-12-11-24-31(28,29)17-9-7-16(8-10-17)25-20-13-19(15-5-3-2-4-6-15)26-21-18(22)14-23-27(20)21/h2-10,13-14,24-25H,11-12H2,1H3