2-[4-(3-chloranyl-4-methyl-phenoxy)-6-methyl-pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-[4-(3-chloranyl-4-methyl-phenoxy)-6-methyl-pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone Openeye Name: 2-[4-(3-chloro-4-methyl-phenoxy)-6-methyl-pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone CAS Name: 2-[[4-(3-chloro-4-methylphenoxy)-6-methyl-2-pyrimidinyl]thio]-1-phenylethanone IUPAC Name: 2-[4-(3-chloro-4-methylphenoxy)-6-methylpyrimidin-2-yl]sulfanyl-1-phenylethanone Traditional Name: 2-[[4-(3-chloro-4-methyl-phenoxy)-6-methyl-pyrimidin-2-yl]thio]-1-phenyl-ethanone Formula: C20H17ClN2O2S MolecularWeight: 384.87918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2=NC(=NC(=C2)C)SCC(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)OC2=NC(=NC(=C2)C)SCC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C20H17ClN2O2S/c1-13-8-9-16(11-17(13)21)25-19-10-14(2)22-20(23-19)26-12-18(24)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3