2-[4-(dimethylamino)-2-[[4-(naphthalen-2-ylcarbonylamino)phenyl]methyl]pyrimidin-5-yl]ethanoate

Systemtic Name: 2-[4-(dimethylamino)-2-[[4-(naphthalen-2-ylcarbonylamino)phenyl]methyl]pyrimidin-5-yl]ethanoate Openeye Name: 2-[4-(dimethylamino)-2-[[4-(naphthalene-2-carbonylamino)phenyl]methyl]pyrimidin-5-yl]acetate CAS Name: 2-[4-(dimethylamino)-2-[[4-[[2-naphthalenyl(oxo)methyl]amino]phenyl]methyl]-5-pyrimidinyl]acetate IUPAC Name: 2-[4-(dimethylamino)-2-[[4-(naphthalene-2-carbonylamino)phenyl]methyl]pyrimidin-5-yl]acetate Traditional Name: 2-[4-(dimethylamino)-2-[4-(2-naphthoylamino)benzyl]pyrimidin-5-yl]acetate Formula: C26H23N4O3- MolecularWeight: 439.48582

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC=C1CC(=O)[O-])CC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CN(C)C1=NC(=NC=C1CC(=O)[O-])CC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H24N4O3/c1-30(2)25-21(15-24(31)32)16-27-23(29-25)13-17-7-11-22(12-8-17)28-26(33)20-10-9-18-5-3-4-6-19(18)14-20/h3-12,14,16H,13,15H2,1-2H3,(H,28,33)(H,31,32)/p-1