4-(4-bromanylpyrazol-1-yl)-N-butyl-benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-butyl-benzamide Openeye Name: 4-(4-bromopyrazol-1-yl)-N-butyl-benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-butylbenzamide IUPAC Name: 4-(4-bromopyrazol-1-yl)-N-butylbenzamide Traditional Name: 4-(4-bromopyrazol-1-yl)-N-butyl-benzamide Formula: C14H16BrN3O MolecularWeight: 322.20034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)N2C=C(C=N2)Br

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)N2C=C(C=N2)Br

InChI

InChI=1S/C14H16BrN3O/c1-2-3-8-16-14(19)11-4-6-13(7-5-11)18-10-12(15)9-17-18/h4-7,9-10H,2-3,8H2,1H3,(H,16,19)