4-bromanyl-N-[3-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-bromo-N-[3-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)amino]-3-oxo-propyl]benzamide CAS Name: 4-bromo-N-[3-[(1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl)amino]-3-oxopropyl]benzamide IUPAC Name: 4-bromo-N-[3-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)amino]-3-oxopropyl]benzamide Traditional Name: 4-bromo-N-[3-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)amino]-3-keto-propyl]benzamide Formula: C18H18BrN5O2 MolecularWeight: 416.27182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrN5O2/c1-11-15-9-14(10-21-17(15)24(2)23-11)22-16(25)7-8-20-18(26)12-3-5-13(19)6-4-12/h3-6,9-10H,7-8H2,1-2H3,(H,20,26)(H,22,25)