N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(3-chloranylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(3-chloranylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(3-chlorophenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-4-[(3-chlorophenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(3-chlorophenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-4-yl]-4-[(3-chlorophenoxy)methyl]thiophene-2-carboxamide Formula: C22H17BrClN3O2S MolecularWeight: 502.81128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC(=CC(=C1)Cl)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrClN3O2S/c23-17-6-4-15(5-7-17)11-27-12-19(10-25-27)26-22(28)21-8-16(14-30-21)13-29-20-3-1-2-18(24)9-20/h1-10,12,14H,11,13H2,(H,26,28)