N-[2-[(2-bromophenyl)methyl]pyrazol-3-yl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-[2-[(2-bromophenyl)methyl]pyrazol-3-yl]-4-thiophen-2-yl-butanamide Openeye Name: N-[2-[(2-bromophenyl)methyl]pyrazol-3-yl]-4-(2-thienyl)butanamide CAS Name: N-[2-[(2-bromophenyl)methyl]-3-pyrazolyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[2-[(2-bromophenyl)methyl]pyrazol-3-yl]-4-thiophen-2-ylbutanamide Traditional Name: N-[2-(2-bromobenzyl)pyrazol-3-yl]-4-(2-thienyl)butyramide Formula: C18H18BrN3OS MolecularWeight: 404.32402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=CC=N2)NC(=O)CCCC3=CC=CS3)Br

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=CC=N2)NC(=O)CCCC3=CC=CS3)Br

InChI

InChI=1S/C18H18BrN3OS/c19-16-8-2-1-5-14(16)13-22-17(10-11-20-22)21-18(23)9-3-6-15-7-4-12-24-15/h1-2,4-5,7-8,10-12H,3,6,9,13H2,(H,21,23)