N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-4-(methoxymethyl)benzamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-4-(methoxymethyl)benzamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-4-(methoxymethyl)benzamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-4-(methoxymethyl)benzamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-4-(methoxymethyl)benzamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-4-(methoxymethyl)benzamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)COC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)COC)C

InChI

InChI=1S/C21H21N3O2S/c1-14-12-15(2)23-21(22-14)27-19-10-8-18(9-11-19)24-20(25)17-6-4-16(5-7-17)13-26-3/h4-12H,13H2,1-3H3,(H,24,25)