N-(3-chloranyl-4-methoxy-phenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O2S/c1-13-10-14(2)24-21(23-13)28-12-15-6-4-5-7-17(15)20(26)25-16-8-9-19(27-3)18(22)11-16/h4-11H,12H2,1-3H3,(H,25,26)