N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(3,5-dimethylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(3,5-dimethylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(3,5-dimethylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[1-[(4-bromophenyl)methyl]-3-pyrazolyl]-4-[(3,5-dimethylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-[(3,5-dimethylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-3-yl]-4-[(3,5-dimethylphenoxy)methyl]thiophene-2-carboxamide Formula: C24H22BrN3O2S MolecularWeight: 496.41938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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