1-butyl-3-[(3,6-dicyclopropyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-butyl-3-[(3,6-dicyclopropyl-1-phenyl-pyrazolo[3,4-b]pyridin-4-yl)carbonylamino]thiourea Openeye Name: 1-butyl-3-[(3,6-dicyclopropyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]thiourea CAS Name: 1-butyl-3-[[(3,6-dicyclopropyl-1-phenyl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]amino]thiourea IUPAC Name: 1-butyl-3-[(3,6-dicyclopropyl-1-phenylpyrazolo[3,4-b]pyridine-4-carbonyl)amino]thiourea Traditional Name: 1-butyl-3-[(3,6-dicyclopropyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carbonyl)amino]thiourea Formula: C24H28N6OS MolecularWeight: 448.58372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)C1=CC(=NC2=C1C(=NN2C3=CC=CC=C3)C4CC4)C5CC5

Isomeric SMILES

CCCCNC(=S)NNC(=O)C1=CC(=NC2=C1C(=NN2C3=CC=CC=C3)C4CC4)C5CC5

InChI

InChI=1S/C24H28N6OS/c1-2-3-13-25-24(32)28-27-23(31)18-14-19(15-9-10-15)26-22-20(18)21(16-11-12-16)29-30(22)17-7-5-4-6-8-17/h4-8,14-16H,2-3,9-13H2,1H3,(H,27,31)(H2,25,28,32)