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

Systemtic Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-methyl-benzamide Openeye Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-methyl-benzamide CAS Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-3-methylbenzamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-methylbenzamide Traditional Name: N-[1-(4-bromobenzyl)-3,5-dimethyl-pyrazol-4-yl]-3-methyl-benzamide Formula: C20H20BrN3O MolecularWeight: 398.2963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H20BrN3O/c1-13-5-4-6-17(11-13)20(25)22-19-14(2)23-24(15(19)3)12-16-7-9-18(21)10-8-16/h4-11H,12H2,1-3H3,(H,22,25)