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

Systemtic Name: 1-[2-[(2-bromanyl-4-propan-2-yl-phenyl)-ethyl-amino]-6-methyl-pyrimidin-4-yl]ethyl methanesulfonate Openeye Name: 1-[2-(2-bromo-N-ethyl-4-isopropyl-anilino)-6-methyl-pyrimidin-4-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 1-[2-(2-bromo-N-ethyl-4-propan-2-ylanilino)-6-methyl-4-pyrimidinyl]ethyl ester IUPAC Name: 1-[2-(2-bromo-N-ethyl-4-propan-2-ylanilino)-6-methylpyrimidin-4-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 1-[2-(2-bromo-N-ethyl-4-isopropyl-anilino)-6-methyl-pyrimidin-4-yl]ethyl ester Formula: C19H26BrN3O3S MolecularWeight: 456.39704

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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)OS(=O)(=O)C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H26BrN3O3S/c1-7-23(18-9-8-15(12(2)3)11-16(18)20)19-21-13(4)10-17(22-19)14(5)26-27(6,24)25/h8-12,14H,7H2,1-6H3