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

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(2,3-dimethylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(2,3-dimethylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-4-[(2,3-dimethylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(2,3-dimethylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-4-yl]-4-[(2,3-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)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=CC=C(C=C4)Br)C

Isomeric SMILES

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

InChI

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