N-[(E)-(2-bromophenyl)methylideneamino]-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-[(E)-(2-bromophenyl)methylideneamino]-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-[(E)-(2-bromophenyl)methyleneamino]-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-[(E)-(2-bromophenyl)methylideneamino]-4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzamide IUPAC Name: N-[(E)-(2-bromophenyl)methylideneamino]-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-[(E)-(2-bromobenzylidene)amino]-4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzamide Formula: C21H19BrN4OS MolecularWeight: 455.37076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NN=CC3=CC=CC=C3Br)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=CC=C3Br)C

InChI

InChI=1S/C21H19BrN4OS/c1-14-11-15(2)25-21(24-14)28-13-16-7-9-17(10-8-16)20(27)26-23-12-18-5-3-4-6-19(18)22/h3-12H,13H2,1-2H3,(H,26,27)/b23-12+