1-phenyl-3-[3-[3-(1H-pyrazolo[3,4-c]pyridin-4-yl)prop-1-ynyl]phenyl]urea

Systemtic Name: 1-phenyl-3-[3-[3-(1H-pyrazolo[3,4-c]pyridin-4-yl)prop-1-ynyl]phenyl]urea Openeye Name: 1-phenyl-3-[3-[3-(1H-pyrazolo[3,4-c]pyridin-4-yl)prop-1-ynyl]phenyl]urea CAS Name: 1-phenyl-3-[3-[3-(1H-pyrazolo[3,4-c]pyridin-4-yl)prop-1-ynyl]phenyl]urea IUPAC Name: 1-phenyl-3-[3-[3-(1H-pyrazolo[3,4-c]pyridin-4-yl)prop-1-ynyl]phenyl]urea Traditional Name: 1-phenyl-3-[3-[3-(1H-pyrazolo[3,4-c]pyridin-4-yl)prop-1-ynyl]phenyl]urea Formula: C22H17N5O MolecularWeight: 367.40328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=CC=CC(=C2)C#CCC3=CN=CC4=C3C=NN4

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=CC(=C2)C#CCC3=CN=CC4=C3C=NN4

InChI

InChI=1S/C22H17N5O/c28-22(25-18-9-2-1-3-10-18)26-19-11-5-7-16(12-19)6-4-8-17-13-23-15-21-20(17)14-24-27-21/h1-3,5,7,9-15H,8H2,(H,24,27)(H2,25,26,28)