N'-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]-4-nitro-benzohydrazide

Systemtic Name: N'-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]-4-nitro-benzohydrazide Openeye Name: N'-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]-4-nitro-benzohydrazide CAS Name: N'-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]-4-nitrobenzohydrazide IUPAC Name: N'-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]-4-nitrobenzohydrazide Traditional Name: N'-[2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetyl]-4-nitro-benzohydrazide Formula: C20H17N5O4S MolecularWeight: 423.44508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O4S/c1-13-11-17(14-5-3-2-4-6-14)22-20(21-13)30-12-18(26)23-24-19(27)15-7-9-16(10-8-15)25(28)29/h2-11H,12H2,1H3,(H,23,26)(H,24,27)