1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-(2,5-dimethyl-1H-indol-3-yl)ethanone

Systemtic Name: 1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-(2,5-dimethyl-1H-indol-3-yl)ethanone Openeye Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-(2,5-dimethyl-1H-indol-3-yl)ethanone CAS Name: 1-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-2-(2,5-dimethyl-1H-indol-3-yl)ethanone IUPAC Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-(2,5-dimethyl-1H-indol-3-yl)ethanone Traditional Name: 1-[4-(5-bromopyrimidin-2-yl)piperazino]-2-(2,5-dimethyl-1H-indol-3-yl)ethanone Formula: C20H22BrN5O MolecularWeight: 428.32558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CC(=O)N3CCN(CC3)C4=NC=C(C=N4)Br)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CC(=O)N3CCN(CC3)C4=NC=C(C=N4)Br)C

InChI

InChI=1S/C20H22BrN5O/c1-13-3-4-18-17(9-13)16(14(2)24-18)10-19(27)25-5-7-26(8-6-25)20-22-11-15(21)12-23-20/h3-4,9,11-12,24H,5-8,10H2,1-2H3