[2-[(2-bromanyl-4-propan-2-yl-phenyl)-ethyl-amino]-6-methyl-pyrimidin-4-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [2-[(2-bromanyl-4-propan-2-yl-phenyl)-ethyl-amino]-6-methyl-pyrimidin-4-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [2-(2-bromo-N-ethyl-4-isopropyl-anilino)-6-methyl-pyrimidin-4-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [2-(2-bromo-N-ethyl-4-propan-2-ylanilino)-6-methyl-4-pyrimidinyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [2-(2-bromo-N-ethyl-4-propan-2-ylanilino)-6-methylpyrimidin-4-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [2-(2-bromo-N-ethyl-4-isopropyl-anilino)-6-methyl-pyrimidin-4-yl]-(4-methylpiperazino)methanone Formula: C22H30BrN5O MolecularWeight: 460.4105

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C=C1)C(C)C)Br)C2=NC(=CC(=N2)C)C(=O)N3CCN(CC3)C

Isomeric SMILES

CCN(C1=C(C=C(C=C1)C(C)C)Br)C2=NC(=CC(=N2)C)C(=O)N3CCN(CC3)C

InChI

InChI=1S/C22H30BrN5O/c1-6-28(20-8-7-17(15(2)3)14-18(20)23)22-24-16(4)13-19(25-22)21(29)27-11-9-26(5)10-12-27/h7-8,13-15H,6,9-12H2,1-5H3