[4-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[[3-(4-bromophenyl)-1H-pyrazol-5-yl]-oxomethyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[3-(4-bromophenyl)-1H-pyrazole-5-carbonyl]piperazino]-(2-thienyl)methanone Formula: C19H17BrN4O2S MolecularWeight: 445.33288

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CS2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CS2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H17BrN4O2S/c20-14-5-3-13(4-6-14)15-12-16(22-21-15)18(25)23-7-9-24(10-8-23)19(26)17-2-1-11-27-17/h1-6,11-12H,7-10H2,(H,21,22)