1-[4-[[4-azanyl-5-(2-ethoxyphenyl)carbonyl-pyrimidin-2-yl]amino]piperidin-1-yl]ethanone

Systemtic Name: 1-[4-[[4-azanyl-5-(2-ethoxyphenyl)carbonyl-pyrimidin-2-yl]amino]piperidin-1-yl]ethanone Openeye Name: 1-[4-[[4-amino-5-(2-ethoxybenzoyl)pyrimidin-2-yl]amino]-1-piperidyl]ethanone CAS Name: 1-[4-[[4-amino-5-[(2-ethoxyphenyl)-oxomethyl]-2-pyrimidinyl]amino]-1-piperidinyl]ethanone IUPAC Name: 1-[4-[[4-amino-5-(2-ethoxybenzoyl)pyrimidin-2-yl]amino]piperidin-1-yl]ethanone Traditional Name: 1-[4-[[4-amino-5-(2-ethoxybenzoyl)pyrimidin-2-yl]amino]piperidino]ethanone Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)C2=CN=C(N=C2N)NC3CCN(CC3)C(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)C2=CN=C(N=C2N)NC3CCN(CC3)C(=O)C

InChI

InChI=1S/C20H25N5O3/c1-3-28-17-7-5-4-6-15(17)18(27)16-12-22-20(24-19(16)21)23-14-8-10-25(11-9-14)13(2)26/h4-7,12,14H,3,8-11H2,1-2H3,(H3,21,22,23,24)