5-bromanyl-4-[2-(1-methylpiperidin-4-yl)ethoxy]-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-2-carbonitrile

Systemtic Name: 5-bromanyl-4-[2-(1-methylpiperidin-4-yl)ethoxy]-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-2-carbonitrile Openeye Name: 5-bromo-4-[2-(1-methyl-4-piperidyl)ethoxy]-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-2-carbonitrile CAS Name: 5-bromo-4-[2-(1-methyl-4-piperidinyl)ethoxy]-6-(6-spiro[2.5]octanylmethylamino)-2-pyrimidinecarbonitrile IUPAC Name: 5-bromo-4-[2-(1-methylpiperidin-4-yl)ethoxy]-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-2-carbonitrile Traditional Name: 5-bromo-4-[2-(1-methyl-4-piperidyl)ethoxy]-6-(spiro[2.5]octan-6-ylmethylamino)pyrimidine-2-carbonitrile Formula: C22H32BrN5O MolecularWeight: 462.42638

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CCOC2=NC(=NC(=C2Br)NCC3CCC4(CC3)CC4)C#N

Isomeric SMILES

CN1CCC(CC1)CCOC2=NC(=NC(=C2Br)NCC3CCC4(CC3)CC4)C#N

InChI

InChI=1S/C22H32BrN5O/c1-28-11-4-16(5-12-28)6-13-29-21-19(23)20(26-18(14-24)27-21)25-15-17-2-7-22(8-3-17)9-10-22/h16-17H,2-13,15H2,1H3,(H,25,26,27)