[4-ethanoyl-2-(pyrimidin-2-ylsulfanylmethyl)phenyl] 2,2-bis(chloranyl)-1-methyl-cyclopropane-1-carboxylate

Systemtic Name: [4-ethanoyl-2-(pyrimidin-2-ylsulfanylmethyl)phenyl] 2,2-bis(chloranyl)-1-methyl-cyclopropane-1-carboxylate Openeye Name: [4-acetyl-2-(pyrimidin-2-ylsulfanylmethyl)phenyl] 2,2-dichloro-1-methyl-cyclopropanecarboxylate CAS Name: 2,2-dichloro-1-methyl-1-cyclopropanecarboxylic acid [4-acetyl-2-[(2-pyrimidinylthio)methyl]phenyl] ester IUPAC Name: [4-acetyl-2-(pyrimidin-2-ylsulfanylmethyl)phenyl] 2,2-dichloro-1-methylcyclopropane-1-carboxylate Traditional Name: 2,2-dichloro-1-methyl-cyclopropanecarboxylic acid [4-acetyl-2-[(2-pyrimidylthio)methyl]phenyl] ester Formula: C18H16Cl2N2O3S MolecularWeight: 411.30224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC(=O)C2(CC2(Cl)Cl)C)CSC3=NC=CC=N3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC(=O)C2(CC2(Cl)Cl)C)CSC3=NC=CC=N3

InChI

InChI=1S/C18H16Cl2N2O3S/c1-11(23)12-4-5-14(25-15(24)17(2)10-18(17,19)20)13(8-12)9-26-16-21-6-3-7-22-16/h3-8H,9-10H2,1-2H3