(2-bromophenyl)-[4-(4-methyl-6-phenylazanyl-pyrimidin-2-yl)piperazin-1-yl]methanone

Systemtic Name: (2-bromophenyl)-[4-(4-methyl-6-phenylazanyl-pyrimidin-2-yl)piperazin-1-yl]methanone Openeye Name: [4-(4-anilino-6-methyl-pyrimidin-2-yl)piperazin-1-yl]-(2-bromophenyl)methanone CAS Name: [4-(4-anilino-6-methyl-2-pyrimidinyl)-1-piperazinyl]-(2-bromophenyl)methanone IUPAC Name: [4-(4-anilino-6-methylpyrimidin-2-yl)piperazin-1-yl]-(2-bromophenyl)methanone Traditional Name: [4-(4-anilino-6-methyl-pyrimidin-2-yl)piperazino]-(2-bromophenyl)methanone Formula: C22H22BrN5O MolecularWeight: 452.34698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C3=CC=CC=C3Br)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C3=CC=CC=C3Br)NC4=CC=CC=C4

InChI

InChI=1S/C22H22BrN5O/c1-16-15-20(25-17-7-3-2-4-8-17)26-22(24-16)28-13-11-27(12-14-28)21(29)18-9-5-6-10-19(18)23/h2-10,15H,11-14H2,1H3,(H,24,25,26)