N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-ethoxy-benzamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-ethoxy-benzamide Openeye Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-ethoxy-benzamide CAS Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-2-ethoxybenzamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-2-ethoxybenzamide Traditional Name: N-[1-(4-bromobenzyl)-3,5-dimethyl-pyrazol-4-yl]-2-ethoxy-benzamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C21H22BrN3O2/c1-4-27-19-8-6-5-7-18(19)21(26)23-20-14(2)24-25(15(20)3)13-16-9-11-17(22)12-10-16/h5-12H,4,13H2,1-3H3,(H,23,26)