N-(4-aminocarbonylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(4-aminocarbonylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(4-carbamoylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-(4-carbamoylphenyl)-2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzamide IUPAC Name: N-(4-carbamoylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(4-carbamoylphenyl)-2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzamide Formula: C21H20N4O2S MolecularWeight: 392.4741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)N)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)N)C

InChI

InChI=1S/C21H20N4O2S/c1-13-11-14(2)24-21(23-13)28-12-16-5-3-4-6-18(16)20(27)25-17-9-7-15(8-10-17)19(22)26/h3-11H,12H2,1-2H3,(H2,22,26)(H,25,27)