1-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-3-(phenylmethyl)urea

Systemtic Name: 1-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]urea CAS Name: 1-[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]urea Traditional Name: 1-benzyl-3-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]urea Formula: C21H23ClN4O MolecularWeight: 382.88652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)NCC2=CC=CC=C2)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)NCC2=CC=CC=C2)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H23ClN4O/c1-21(2,3)18-13-19(26(25-18)17-12-8-7-11-16(17)22)24-20(27)23-14-15-9-5-4-6-10-15/h4-13H,14H2,1-3H3,(H2,23,24,27)