N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(2,6-dimethylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(2,6-dimethylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(2,6-dimethylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[1-[(4-bromophenyl)methyl]-3-pyrazolyl]-4-[(2,6-dimethylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(2,6-dimethylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-3-yl]-4-[(2,6-dimethylphenoxy)methyl]thiophene-2-carboxamide Formula: C24H22BrN3O2S MolecularWeight: 496.41938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC2=CSC(=C2)C(=O)NC3=NN(C=C3)CC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC2=CSC(=C2)C(=O)NC3=NN(C=C3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C24H22BrN3O2S/c1-16-4-3-5-17(2)23(16)30-14-19-12-21(31-15-19)24(29)26-22-10-11-28(27-22)13-18-6-8-20(25)9-7-18/h3-12,15H,13-14H2,1-2H3,(H,26,27,29)