2-(4-bromanylphenoxy)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]propanamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-2-(4-bromophenoxy)-N-methyl-propanamide CAS Name: 2-(4-bromophenoxy)-N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]propanamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-2-(4-bromophenoxy)-N-methylpropanamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-2-(4-bromophenoxy)-N-methyl-propionamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CN(N=C1)CC2=CC=CC=C2)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)N(C)CC1=CN(N=C1)CC2=CC=CC=C2)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O2/c1-16(27-20-10-8-19(22)9-11-20)21(26)24(2)13-18-12-23-25(15-18)14-17-6-4-3-5-7-17/h3-12,15-16H,13-14H2,1-2H3