4-bromanyl-N-(4-butan-2-ylphenyl)-3-[(2-chlorophenyl)carbonylamino]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-bromanyl-N-(4-butan-2-ylphenyl)-3-[(2-chlorophenyl)carbonylamino]-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(4-sec-butylphenyl)-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-N-(4-butan-2-ylphenyl)-3-[[(2-chlorophenyl)-oxomethyl]amino]-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-N-(4-butan-2-ylphenyl)-3-[(2-chlorobenzoyl)amino]-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(4-sec-butylphenyl)-1H-pyrazole-5-carboxamide Formula: C21H20BrClN4O2 MolecularWeight: 475.7661

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(C(=NN2)NC(=O)C3=CC=CC=C3Cl)Br

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(C(=NN2)NC(=O)C3=CC=CC=C3Cl)Br

InChI

InChI=1S/C21H20BrClN4O2/c1-3-12(2)13-8-10-14(11-9-13)24-21(29)18-17(22)19(27-26-18)25-20(28)15-6-4-5-7-16(15)23/h4-12H,3H2,1-2H3,(H,24,29)(H2,25,26,27,28)