1-[1-[4-azanyl-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]-1-oxidanylidene-propan-2-yl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[1-[4-azanyl-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-5-yl]-1-oxidanylidene-propan-2-yl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[2-(4-amino-1,3-dimethyl-2,6-dioxo-pyrimidin-5-yl)-1-methyl-2-oxo-ethyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[1-(4-amino-1,3-dimethyl-2,6-dioxo-5-pyrimidinyl)-1-oxopropan-2-yl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[1-(4-amino-1,3-dimethyl-2,6-dioxopyrimidin-5-yl)-1-oxopropan-2-yl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[2-(4-amino-2,6-diketo-1,3-dimethyl-pyrimidin-5-yl)-2-keto-1-methyl-ethyl]-N-phenyl-nipecotamide Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=C(N(C(=O)N(C1=O)C)C)N)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=C(N(C(=O)N(C1=O)C)C)N)N2CCCC(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H27N5O4/c1-13(17(27)16-18(22)24(2)21(30)25(3)20(16)29)26-11-7-8-14(12-26)19(28)23-15-9-5-4-6-10-15/h4-6,9-10,13-14H,7-8,11-12,22H2,1-3H3,(H,23,28)