1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-(3,4-dichlorophenyl)urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-(3,4-dichlorophenyl)urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-(3,4-dichlorophenyl)urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-(3,4-dichlorophenyl)urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-(3,4-dichlorophenyl)urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-(3,4-dichlorophenyl)urea Formula: C21H22Cl2N4O MolecularWeight: 417.33158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H22Cl2N4O/c1-13-5-8-15(9-6-13)27-19(12-18(26-27)21(2,3)4)25-20(28)24-14-7-10-16(22)17(23)11-14/h5-12H,1-4H3,(H2,24,25,28)