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

Systemtic Name: 4-bromanyl-3-[(2-chlorophenyl)carbonylamino]-N-(pyridin-4-ylmethyl)-1H-pyrazole-5-carboxamide Openeye Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(4-pyridylmethyl)-1H-pyrazole-5-carboxamide CAS Name: 4-bromo-3-[[(2-chlorophenyl)-oxomethyl]amino]-N-(pyridin-4-ylmethyl)-1H-pyrazole-5-carboxamide IUPAC Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(pyridin-4-ylmethyl)-1H-pyrazole-5-carboxamide Traditional Name: 4-bromo-3-[(2-chlorobenzoyl)amino]-N-(4-pyridylmethyl)-1H-pyrazole-5-carboxamide Formula: C17H13BrClN5O2 MolecularWeight: 434.67442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NNC(=C2Br)C(=O)NCC3=CC=NC=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NNC(=C2Br)C(=O)NCC3=CC=NC=C3)Cl

InChI

InChI=1S/C17H13BrClN5O2/c18-13-14(17(26)21-9-10-5-7-20-8-6-10)23-24-15(13)22-16(25)11-3-1-2-4-12(11)19/h1-8H,9H2,(H,21,26)(H2,22,23,24,25)