1-[5-tert-butyl-2-(5-nitropyridin-2-yl)pyrazol-3-yl]-3-phenyl-urea

Systemtic Name: 1-[5-tert-butyl-2-(5-nitropyridin-2-yl)pyrazol-3-yl]-3-phenyl-urea Openeye Name: 1-[5-tert-butyl-2-(5-nitro-2-pyridyl)pyrazol-3-yl]-3-phenyl-urea CAS Name: 1-[5-tert-butyl-2-(5-nitro-2-pyridinyl)-3-pyrazolyl]-3-phenylurea IUPAC Name: 1-[5-tert-butyl-2-(5-nitropyridin-2-yl)pyrazol-3-yl]-3-phenylurea Traditional Name: 1-[5-tert-butyl-2-(5-nitro-2-pyridyl)pyrazol-3-yl]-3-phenyl-urea Formula: C19H20N6O3 MolecularWeight: 380.4005

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=CC=C2)C3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=CC=C2)C3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O3/c1-19(2,3)15-11-17(22-18(26)21-13-7-5-4-6-8-13)24(23-15)16-10-9-14(12-20-16)25(27)28/h4-12H,1-3H3,(H2,21,22,26)