O-[2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-yl] N,N-diethylcarbamothioate

Systemtic Name: O-[2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-yl] N,N-diethylcarbamothioate Openeye Name: O-[2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidin-4-yl] N,N-diethylcarbamothioate CAS Name: N,N-diethylcarbamothioic acid O-[[2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-6-methyl-4-pyrimidinyl]] ester IUPAC Name: O-[2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-yl] N,N-diethylcarbamothioate Traditional Name: N,N-diethylthiocarbamic acid O-[2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-6-methyl-pyrimidin-4-yl] ester Formula: C18H20ClN3O2S2 MolecularWeight: 409.9533

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)OC1=NC(=NC(=C1)C)SCC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCN(CC)C(=S)OC1=NC(=NC(=C1)C)SCC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H20ClN3O2S2/c1-4-22(5-2)18(25)24-16-10-12(3)20-17(21-16)26-11-15(23)13-6-8-14(19)9-7-13/h6-10H,4-5,11H2,1-3H3