2-[6-methyl-2-[(phenylmethyl)amino]pyrimidin-4-yl]oxy-N-[(3-nitrophenyl)methylideneamino]ethanamide

Systemtic Name: 2-[6-methyl-2-[(phenylmethyl)amino]pyrimidin-4-yl]oxy-N-[(3-nitrophenyl)methylideneamino]ethanamide Openeye Name: 2-[2-(benzylamino)-6-methyl-pyrimidin-4-yl]oxy-N-[(3-nitrophenyl)methyleneamino]acetamide CAS Name: 2-[[6-methyl-2-[(phenylmethyl)amino]-4-pyrimidinyl]oxy]-N-[(3-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-[2-(benzylamino)-6-methylpyrimidin-4-yl]oxy-N-[(3-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-[2-(benzylamino)-6-methyl-pyrimidin-4-yl]oxy-N-[(3-nitrobenzylidene)amino]acetamide Formula: C21H20N6O4 MolecularWeight: 420.4213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NCC2=CC=CC=C2)OCC(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)NCC2=CC=CC=C2)OCC(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O4/c1-15-10-20(25-21(24-15)22-12-16-6-3-2-4-7-16)31-14-19(28)26-23-13-17-8-5-9-18(11-17)27(29)30/h2-11,13H,12,14H2,1H3,(H,26,28)(H,22,24,25)