[3-(4-bromophenyl)-5-[5-(methylamino)pentyl]pyrazol-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [3-(4-bromophenyl)-5-[5-(methylamino)pentyl]pyrazol-1-yl]-thiophen-2-yl-methanone Openeye Name: [3-(4-bromophenyl)-5-[5-(methylamino)pentyl]pyrazol-1-yl]-(2-thienyl)methanone CAS Name: [3-(4-bromophenyl)-5-[5-(methylamino)pentyl]-1-pyrazolyl]-thiophen-2-ylmethanone IUPAC Name: [3-(4-bromophenyl)-5-[5-(methylamino)pentyl]pyrazol-1-yl]-thiophen-2-ylmethanone Traditional Name: [3-(4-bromophenyl)-5-[5-(methylamino)pentyl]pyrazol-1-yl]-(2-thienyl)methanone Formula: C20H22BrN3OS MolecularWeight: 432.37718

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCCC1=CC(=NN1C(=O)C2=CC=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

CNCCCCCC1=CC(=NN1C(=O)C2=CC=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3OS/c1-22-12-4-2-3-6-17-14-18(15-8-10-16(21)11-9-15)23-24(17)20(25)19-7-5-13-26-19/h5,7-11,13-14,22H,2-4,6,12H2,1H3