3-[(3-bromophenyl)sulfonylamino]-N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)propanamide

Systemtic Name: 3-[(3-bromophenyl)sulfonylamino]-N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)propanamide Openeye Name: 3-[(3-bromophenyl)sulfonylamino]-N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)propanamide CAS Name: 3-[(3-bromophenyl)sulfonylamino]-N-(1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl)propanamide IUPAC Name: 3-[(3-bromophenyl)sulfonylamino]-N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)propanamide Traditional Name: 3-[(3-bromophenyl)sulfonylamino]-N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)propionamide Formula: C17H18BrN5O3S MolecularWeight: 452.32552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)NC(=O)CCNS(=O)(=O)C3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)NC(=O)CCNS(=O)(=O)C3=CC(=CC=C3)Br)C

InChI

InChI=1S/C17H18BrN5O3S/c1-11-15-9-13(10-19-17(15)23(2)22-11)21-16(24)6-7-20-27(25,26)14-5-3-4-12(18)8-14/h3-5,8-10,20H,6-7H2,1-2H3,(H,21,24)