N-[(E)-[2-(2-ethylsulfanyl-6-methyl-pyrimidin-4-yl)oxy-1-phenyl-ethylidene]amino]-4-nitro-benzamide

Systemtic Name: N-[(E)-[2-(2-ethylsulfanyl-6-methyl-pyrimidin-4-yl)oxy-1-phenyl-ethylidene]amino]-4-nitro-benzamide Openeye Name: N-[(E)-[2-(2-ethylsulfanyl-6-methyl-pyrimidin-4-yl)oxy-1-phenyl-ethylidene]amino]-4-nitro-benzamide CAS Name: N-[(E)-[2-[[2-(ethylthio)-6-methyl-4-pyrimidinyl]oxy]-1-phenylethylidene]amino]-4-nitrobenzamide IUPAC Name: N-[(E)-[2-(2-ethylsulfanyl-6-methylpyrimidin-4-yl)oxy-1-phenylethylidene]amino]-4-nitrobenzamide Traditional Name: N-[(E)-[2-[2-(ethylthio)-6-methyl-pyrimidin-4-yl]oxy-1-phenyl-ethylidene]amino]-4-nitro-benzamide Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=CC(=N1)OCC(=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C

Isomeric SMILES

CCSC1=NC(=CC(=N1)OC/C(=N/NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])/C3=CC=CC=C3)C

InChI

InChI=1S/C22H21N5O4S/c1-3-32-22-23-15(2)13-20(24-22)31-14-19(16-7-5-4-6-8-16)25-26-21(28)17-9-11-18(12-10-17)27(29)30/h4-13H,3,14H2,1-2H3,(H,26,28)/b25-19-