N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3OC)OC)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3OC)OC)Cl)C

InChI

InChI=1S/C22H22ClN3O3S/c1-13-9-14(2)25-22(24-13)30-12-15-7-5-6-8-16(15)21(27)26-18-10-17(23)19(28-3)11-20(18)29-4/h5-11H,12H2,1-4H3,(H,26,27)