N-[4-bromanyl-1-[(3-methylphenyl)methyl]pyrazol-3-yl]propanamide

Systemtic Name: N-[4-bromanyl-1-[(3-methylphenyl)methyl]pyrazol-3-yl]propanamide Openeye Name: N-[4-bromo-1-(m-tolylmethyl)pyrazol-3-yl]propanamide CAS Name: N-[4-bromo-1-[(3-methylphenyl)methyl]-3-pyrazolyl]propanamide IUPAC Name: N-[4-bromo-1-[(3-methylphenyl)methyl]pyrazol-3-yl]propanamide Traditional Name: N-[4-bromo-1-(3-methylbenzyl)pyrazol-3-yl]propionamide Formula: C14H16BrN3O MolecularWeight: 322.20034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NN(C=C1Br)CC2=CC=CC(=C2)C

Isomeric SMILES

CCC(=O)NC1=NN(C=C1Br)CC2=CC=CC(=C2)C

InChI

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