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

Systemtic Name: [2-[(2-bromanyl-4-propan-2-yl-phenyl)-ethyl-amino]-6-methyl-pyrimidin-4-yl]-piperidin-1-yl-methanone Openeye Name: [2-(2-bromo-N-ethyl-4-isopropyl-anilino)-6-methyl-pyrimidin-4-yl]-(1-piperidyl)methanone CAS Name: [2-(2-bromo-N-ethyl-4-propan-2-ylanilino)-6-methyl-4-pyrimidinyl]-(1-piperidinyl)methanone IUPAC Name: [2-(2-bromo-N-ethyl-4-propan-2-ylanilino)-6-methylpyrimidin-4-yl]-piperidin-1-ylmethanone Traditional Name: [2-(2-bromo-N-ethyl-4-isopropyl-anilino)-6-methyl-pyrimidin-4-yl]-piperidino-methanone Formula: C22H29BrN4O MolecularWeight: 445.39586

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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)N3CCCCC3

Isomeric SMILES

CCN(C1=C(C=C(C=C1)C(C)C)Br)C2=NC(=CC(=N2)C)C(=O)N3CCCCC3

InChI

InChI=1S/C22H29BrN4O/c1-5-27(20-10-9-17(15(2)3)14-18(20)23)22-24-16(4)13-19(25-22)21(28)26-11-7-6-8-12-26/h9-10,13-15H,5-8,11-12H2,1-4H3