N-[(Z)-[2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-1-phenyl-ethylidene]amino]-4-nitro-benzamide

Systemtic Name: N-[(Z)-[2-[(5-ethyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-1-phenyl-ethylidene]amino]-4-nitro-benzamide Openeye Name: N-[(Z)-[2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-1-phenyl-ethylidene]amino]-4-nitro-benzamide CAS Name: N-[(Z)-[2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-1-phenylethylidene]amino]-4-nitrobenzamide IUPAC Name: N-[(Z)-[2-[(5-ethyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-1-phenylethylidene]amino]-4-nitrobenzamide Traditional Name: N-[(Z)-[2-[(5-ethyl-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-1-phenyl-ethylidene]amino]-4-nitro-benzamide Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)SC/C(=N\NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])/C3=CC=CC=C3)C

InChI

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