1-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-[4-(pyridin-4-ylmethyl)phenyl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-[4-(pyridin-4-ylmethyl)phenyl]urea Openeye Name: 1-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-[4-(4-pyridylmethyl)phenyl]urea CAS Name: 1-[5-tert-butyl-2-(4-nitrophenyl)-3-pyrazolyl]-3-[4-(pyridin-4-ylmethyl)phenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-[4-(pyridin-4-ylmethyl)phenyl]urea Traditional Name: 1-[5-tert-butyl-2-(4-nitrophenyl)pyrazol-3-yl]-3-[4-(4-pyridylmethyl)phenyl]urea Formula: C26H26N6O3 MolecularWeight: 470.52304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H26N6O3/c1-26(2,3)23-17-24(31(30-23)21-8-10-22(11-9-21)32(34)35)29-25(33)28-20-6-4-18(5-7-20)16-19-12-14-27-15-13-19/h4-15,17H,16H2,1-3H3,(H2,28,29,33)