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

Systemtic Name: 4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-N-(4-oxidanylcyclohexyl)-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(4-hydroxycyclohexyl)-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-3-[[(2-chlorophenyl)-oxomethyl]amino]-N-(4-hydroxycyclohexyl)-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(4-hydroxycyclohexyl)-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(4-hydroxycyclohexyl)-1H-pyrazole-5-carboxamide Formula: C17H18BrClN4O3 MolecularWeight: 441.70682

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=C(C(=NN2)NC(=O)C3=CC=CC=C3Cl)Br)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=C(C(=NN2)NC(=O)C3=CC=CC=C3Cl)Br)O

InChI

InChI=1S/C17H18BrClN4O3/c18-13-14(17(26)20-9-5-7-10(24)8-6-9)22-23-15(13)21-16(25)11-3-1-2-4-12(11)19/h1-4,9-10,24H,5-8H2,(H,20,26)(H2,21,22,23,25)