2-(4-bromanylpyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-homoveratryl-butyramide Formula: C17H22BrN3O3 MolecularWeight: 396.27888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCC1=CC(=C(C=C1)OC)OC)N2C=C(C=N2)Br

Isomeric SMILES

CCC(C(=O)NCCC1=CC(=C(C=C1)OC)OC)N2C=C(C=N2)Br

InChI

InChI=1S/C17H22BrN3O3/c1-4-14(21-11-13(18)10-20-21)17(22)19-8-7-12-5-6-15(23-2)16(9-12)24-3/h5-6,9-11,14H,4,7-8H2,1-3H3,(H,19,22)