(2-azanyl-6-methyl-pyrimidin-4-yl)-[(3R)-3-[1-(2-methylpropyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone

Systemtic Name: (2-azanyl-6-methyl-pyrimidin-4-yl)-[(3R)-3-[1-(2-methylpropyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone Openeye Name: (2-amino-6-methyl-pyrimidin-4-yl)-[(3R)-3-(1-isobutylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone CAS Name: (2-amino-6-methyl-4-pyrimidinyl)-[(3R)-3-[1-(2-methylpropyl)-4-piperidin-1-iumyl]-1-pyrrolidinyl]methanone IUPAC Name: (2-amino-6-methylpyrimidin-4-yl)-[(3R)-3-[1-(2-methylpropyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone Traditional Name: (2-amino-6-methyl-pyrimidin-4-yl)-[(3R)-3-(1-isobutylpiperidin-1-ium-4-yl)pyrrolidino]methanone Formula: C19H32N5O+ MolecularWeight: 346.49028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C(=O)N2CCC(C2)C3CC[NH+](CC3)CC(C)C)N

Isomeric SMILES

CC1=NC(=NC(=C1)C(=O)N2CC[C@@H](C2)C3CC[NH+](CC3)CC(C)C)N

InChI

InChI=1S/C19H31N5O/c1-13(2)11-23-7-4-15(5-8-23)16-6-9-24(12-16)18(25)17-10-14(3)21-19(20)22-17/h10,13,15-16H,4-9,11-12H2,1-3H3,(H2,20,21,22)/p+1/t16-/m0/s1