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

Systemtic Name: N-[4-bromanyl-1-[(3-methylphenyl)methyl]pyrazol-3-yl]cyclobutanecarboxamide Openeye Name: N-[4-bromo-1-(m-tolylmethyl)pyrazol-3-yl]cyclobutanecarboxamide CAS Name: N-[4-bromo-1-[(3-methylphenyl)methyl]-3-pyrazolyl]cyclobutanecarboxamide IUPAC Name: N-[4-bromo-1-[(3-methylphenyl)methyl]pyrazol-3-yl]cyclobutanecarboxamide Traditional Name: N-[4-bromo-1-(3-methylbenzyl)pyrazol-3-yl]cyclobutanecarboxamide Formula: C16H18BrN3O MolecularWeight: 348.23762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=C(C(=N2)NC(=O)C3CCC3)Br

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=C(C(=N2)NC(=O)C3CCC3)Br

InChI

InChI=1S/C16H18BrN3O/c1-11-4-2-5-12(8-11)9-20-10-14(17)15(19-20)18-16(21)13-6-3-7-13/h2,4-5,8,10,13H,3,6-7,9H2,1H3,(H,18,19,21)