2-(4-bromanylpyrazol-1-yl)-N-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]butanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[1-(o-tolylmethyl)pyrazol-3-yl]butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[1-[(2-methylphenyl)methyl]-3-pyrazolyl]butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[1-(2-methylbenzyl)pyrazol-3-yl]butyramide Formula: C18H20BrN5O MolecularWeight: 402.2883

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN(C=C1)CC2=CC=CC=C2C)N3C=C(C=N3)Br

Isomeric SMILES

CCC(C(=O)NC1=NN(C=C1)CC2=CC=CC=C2C)N3C=C(C=N3)Br

InChI

InChI=1S/C18H20BrN5O/c1-3-16(24-12-15(19)10-20-24)18(25)21-17-8-9-23(22-17)11-14-7-5-4-6-13(14)2/h4-10,12,16H,3,11H2,1-2H3,(H,21,22,25)