1-[(2-cyanopyrimidin-4-yl)-(2,2-dimethylpropyl)amino]-3-(3-fluorophenyl)urea

Systemtic Name: 1-[(2-cyanopyrimidin-4-yl)-(2,2-dimethylpropyl)amino]-3-(3-fluorophenyl)urea Openeye Name: 1-[(2-cyanopyrimidin-4-yl)-(2,2-dimethylpropyl)amino]-3-(3-fluorophenyl)urea CAS Name: 1-[(2-cyano-4-pyrimidinyl)-(2,2-dimethylpropyl)amino]-3-(3-fluorophenyl)urea IUPAC Name: 1-[(2-cyanopyrimidin-4-yl)-(2,2-dimethylpropyl)amino]-3-(3-fluorophenyl)urea Traditional Name: 1-[(2-cyanopyrimidin-4-yl)-neopentyl-amino]-3-(3-fluorophenyl)urea Formula: C17H19FN6O MolecularWeight: 342.370763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN(C1=NC(=NC=C1)C#N)NC(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)(C)CN(C1=NC(=NC=C1)C#N)NC(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C17H19FN6O/c1-17(2,3)11-24(15-7-8-20-14(10-19)22-15)23-16(25)21-13-6-4-5-12(18)9-13/h4-9H,11H2,1-3H3,(H2,21,23,25)