N3-[2-(5-azanylpyridin-2-yl)ethyl]-N2-[1-(dimethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]oxirane-2,3-dicarboxamide

Systemtic Name: N3-[2-(5-azanylpyridin-2-yl)ethyl]-N2-[1-(dimethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]oxirane-2,3-dicarboxamide Openeye Name: N3-[2-(5-amino-2-pyridyl)ethyl]-N2-[1-benzyl-2-(dimethylamino)-2-oxo-ethyl]oxirane-2,3-dicarboxamide CAS Name: N3-[2-(5-amino-2-pyridinyl)ethyl]-N2-[1-(dimethylamino)-1-oxo-3-phenylpropan-2-yl]oxirane-2,3-dicarboxamide IUPAC Name: 3-N-[2-(5-aminopyridin-2-yl)ethyl]-2-N-[1-(dimethylamino)-1-oxo-3-phenylpropan-2-yl]oxirane-2,3-dicarboxamide Traditional Name: N'-[2-(5-amino-2-pyridyl)ethyl]-N-[1-benzyl-2-(dimethylamino)-2-keto-ethyl]oxirane-2,3-dicarboxamide Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(CC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)NCCC3=NC=C(C=C3)N

Isomeric SMILES

CN(C)C(=O)C(CC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)NCCC3=NC=C(C=C3)N

InChI

InChI=1S/C22H27N5O4/c1-27(2)22(30)17(12-14-6-4-3-5-7-14)26-21(29)19-18(31-19)20(28)24-11-10-16-9-8-15(23)13-25-16/h3-9,13,17-19H,10-12,23H2,1-2H3,(H,24,28)(H,26,29)