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

Systemtic Name: (2-iodanylphenyl)-[4-(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]methanone Openeye Name: (2-iodophenyl)-[4-[4-methyl-6-(1-piperidyl)pyrimidin-2-yl]piperazin-1-yl]methanone CAS Name: (2-iodophenyl)-[4-[4-methyl-6-(1-piperidinyl)-2-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (2-iodophenyl)-[4-(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)piperazin-1-yl]methanone Traditional Name: (2-iodophenyl)-[4-(4-methyl-6-piperidino-pyrimidin-2-yl)piperazino]methanone Formula: C21H26IN5O MolecularWeight: 491.36851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C3=CC=CC=C3I)N4CCCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C3=CC=CC=C3I)N4CCCCC4

InChI

InChI=1S/C21H26IN5O/c1-16-15-19(25-9-5-2-6-10-25)24-21(23-16)27-13-11-26(12-14-27)20(28)17-7-3-4-8-18(17)22/h3-4,7-8,15H,2,5-6,9-14H2,1H3