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

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-4-propan-2-yloxy-benzamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-4-isopropoxy-benzamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-4-propan-2-yloxybenzamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-4-isopropoxy-benzamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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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)OC(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O2S/c1-14(2)27-19-9-5-17(6-10-19)21(26)25-18-7-11-20(12-8-18)28-22-23-15(3)13-16(4)24-22/h5-14H,1-4H3,(H,25,26)