1-[2-[2,6-bis(chloranyl)phenyl]-5-tert-butyl-pyrazol-3-yl]-3-[4-(pyridin-4-ylmethyl)phenyl]urea

Systemtic Name: 1-[2-[2,6-bis(chloranyl)phenyl]-5-tert-butyl-pyrazol-3-yl]-3-[4-(pyridin-4-ylmethyl)phenyl]urea Openeye Name: 1-[5-tert-butyl-2-(2,6-dichlorophenyl)pyrazol-3-yl]-3-[4-(4-pyridylmethyl)phenyl]urea CAS Name: 1-[5-tert-butyl-2-(2,6-dichlorophenyl)-3-pyrazolyl]-3-[4-(pyridin-4-ylmethyl)phenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(2,6-dichlorophenyl)pyrazol-3-yl]-3-[4-(pyridin-4-ylmethyl)phenyl]urea Traditional Name: 1-[5-tert-butyl-2-(2,6-dichlorophenyl)pyrazol-3-yl]-3-[4-(4-pyridylmethyl)phenyl]urea Formula: C26H25Cl2N5O MolecularWeight: 494.4156

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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=C(C=CC=C4Cl)Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3)C4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C26H25Cl2N5O/c1-26(2,3)22-16-23(33(32-22)24-20(27)5-4-6-21(24)28)31-25(34)30-19-9-7-17(8-10-19)15-18-11-13-29-14-12-18/h4-14,16H,15H2,1-3H3,(H2,30,31,34)