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

Systemtic Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-[(E)-naphthalen-1-ylmethylideneamino]benzamide Openeye Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-[(E)-1-naphthylmethyleneamino]benzamide CAS Name: 4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-N-[(E)-1-naphthalenylmethylideneamino]benzamide IUPAC Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-[(E)-naphthalen-1-ylmethylideneamino]benzamide Traditional Name: 4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-N-[(E)-1-naphthylmethyleneamino]benzamide Formula: C25H22N4OS MolecularWeight: 426.53338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NN=CC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C25H22N4OS/c1-17-14-18(2)28-25(27-17)31-16-19-10-12-21(13-11-19)24(30)29-26-15-22-8-5-7-20-6-3-4-9-23(20)22/h3-15H,16H2,1-2H3,(H,29,30)/b26-15+