2-(4-bromanylpyrazol-1-yl)-N-[(3,4-diethoxyphenyl)methyl]butanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[(3,4-diethoxyphenyl)methyl]butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[(3,4-diethoxyphenyl)methyl]butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[(3,4-diethoxyphenyl)methyl]butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[(3,4-diethoxyphenyl)methyl]butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-(3,4-diethoxybenzyl)butyramide Formula: C18H24BrN3O3 MolecularWeight: 410.30546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC(=C(C=C1)OCC)OCC)N2C=C(C=N2)Br

Isomeric SMILES

CCC(C(=O)NCC1=CC(=C(C=C1)OCC)OCC)N2C=C(C=N2)Br

InChI

InChI=1S/C18H24BrN3O3/c1-4-15(22-12-14(19)11-21-22)18(23)20-10-13-7-8-16(24-5-2)17(9-13)25-6-3/h7-9,11-12,15H,4-6,10H2,1-3H3,(H,20,23)