[1-(4-methylpiperidin-1-yl)-1-oxidanylidene-5-(pyrimidin-2-ylamino)pentan-2-yl]carbamoyl hydrogen carbonate

Systemtic Name: [1-(4-methylpiperidin-1-yl)-1-oxidanylidene-5-(pyrimidin-2-ylamino)pentan-2-yl]carbamoyl hydrogen carbonate Openeye Name: [1-(4-methylpiperidine-1-carbonyl)-4-(pyrimidin-2-ylamino)butyl]carbamoyl hydrogen carbonate CAS Name: carbonic acid [[[1-(4-methyl-1-piperidinyl)-1-oxo-5-(2-pyrimidinylamino)pentan-2-yl]amino]-oxomethyl] ester IUPAC Name: [1-(4-methylpiperidin-1-yl)-1-oxo-5-(pyrimidin-2-ylamino)pentan-2-yl]carbamoyl hydrogen carbonate Traditional Name: carbonic acid [1-(4-methylpiperidine-1-carbonyl)-4-(2-pyrimidylamino)butyl]carbamoyl ester Formula: C17H25N5O5 MolecularWeight: 379.4109

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CCCNC2=NC=CC=N2)NC(=O)OC(=O)O

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CCCNC2=NC=CC=N2)NC(=O)OC(=O)O

InChI

InChI=1S/C17H25N5O5/c1-12-5-10-22(11-6-12)14(23)13(21-16(24)27-17(25)26)4-2-7-18-15-19-8-3-9-20-15/h3,8-9,12-13H,2,4-7,10-11H2,1H3,(H,21,24)(H,25,26)(H,18,19,20)