(3-iodanylphenyl)-[4-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]methanone

Systemtic Name: (3-iodanylphenyl)-[4-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]methanone Openeye Name: (3-iodophenyl)-[4-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]methanone CAS Name: (3-iodophenyl)-[4-[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (3-iodophenyl)-[4-(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)piperazin-1-yl]methanone Traditional Name: (3-iodophenyl)-[4-(4-methyl-6-pyrrolidino-pyrimidin-2-yl)piperazino]methanone Formula: C20H24IN5O MolecularWeight: 477.34193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)I)N4CCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)I)N4CCCC4

InChI

InChI=1S/C20H24IN5O/c1-15-13-18(24-7-2-3-8-24)23-20(22-15)26-11-9-25(10-12-26)19(27)16-5-4-6-17(21)14-16/h4-6,13-14H,2-3,7-12H2,1H3