2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-N-[(2-nitrophenyl)methylideneamino]ethanamide

Systemtic Name: 2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-N-[(2-nitrophenyl)methylideneamino]ethanamide Openeye Name: 2-(4-methyl-6-morpholino-pyrimidin-2-yl)sulfanyl-N-[(2-nitrophenyl)methyleneamino]acetamide CAS Name: 2-[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]-N-[(2-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanyl-N-[(2-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-[(4-methyl-6-morpholino-pyrimidin-2-yl)thio]-N-[(2-nitrobenzylidene)amino]acetamide Formula: C18H20N6O4S MolecularWeight: 416.4542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC=CC=C2[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC=CC=C2[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C18H20N6O4S/c1-13-10-16(23-6-8-28-9-7-23)21-18(20-13)29-12-17(25)22-19-11-14-4-2-3-5-15(14)24(26)27/h2-5,10-11H,6-9,12H2,1H3,(H,22,25)