4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]benzamide

Systemtic Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]benzamide Openeye Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]benzamide CAS Name: 4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]benzamide IUPAC Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]benzamide Traditional Name: 4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-N-[(E)-1-(4-propoxyphenyl)ethylideneamino]benzamide Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=NNC(=O)C2=CC=C(C=C2)CSC3=NC(=CC(=N3)C)C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C(=N/NC(=O)C2=CC=C(C=C2)CSC3=NC(=CC(=N3)C)C)/C

InChI

InChI=1S/C25H28N4O2S/c1-5-14-31-23-12-10-21(11-13-23)19(4)28-29-24(30)22-8-6-20(7-9-22)16-32-25-26-17(2)15-18(3)27-25/h6-13,15H,5,14,16H2,1-4H3,(H,29,30)/b28-19+