N-methyl-N-[1-[2-[(6-oxidanylidene-1H-pyrimidin-2-yl)amino]ethyl]piperidin-4-yl]-1,4-benzodioxine-5-carboxamide

Systemtic Name: N-methyl-N-[1-[2-[(6-oxidanylidene-1H-pyrimidin-2-yl)amino]ethyl]piperidin-4-yl]-1,4-benzodioxine-5-carboxamide Openeye Name: N-methyl-N-[1-[2-[(6-oxo-1H-pyrimidin-2-yl)amino]ethyl]-4-piperidyl]-1,4-benzodioxine-5-carboxamide CAS Name: N-methyl-N-[1-[2-[(6-oxo-1H-pyrimidin-2-yl)amino]ethyl]-4-piperidinyl]-1,4-benzodioxin-5-carboxamide IUPAC Name: N-methyl-N-[1-[2-[(6-oxo-1H-pyrimidin-2-yl)amino]ethyl]piperidin-4-yl]-1,4-benzodioxine-5-carboxamide Traditional Name: N-[1-[2-[(6-keto-1H-pyrimidin-2-yl)amino]ethyl]-4-piperidyl]-N-methyl-1,4-benzodioxin-5-carboxamide Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)CCNC2=NC=CC(=O)N2)C(=O)C3=C4C(=CC=C3)OC=CO4

Isomeric SMILES

CN(C1CCN(CC1)CCNC2=NC=CC(=O)N2)C(=O)C3=C4C(=CC=C3)OC=CO4

InChI

InChI=1S/C21H25N5O4/c1-25(20(28)16-3-2-4-17-19(16)30-14-13-29-17)15-6-10-26(11-7-15)12-9-23-21-22-8-5-18(27)24-21/h2-5,8,13-15H,6-7,9-12H2,1H3,(H2,22,23,24,27)