1-[3-(3,4-dichlorophenyl)-1,2-oxazol-5-yl]-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[3-(3,4-dichlorophenyl)-1,2-oxazol-5-yl]-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanyl-ethanone Openeye Name: 1-[3-(3,4-dichlorophenyl)isoxazol-5-yl]-2-[4-(2-thienyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-[3-(3,4-dichlorophenyl)-5-isoxazolyl]-2-[(4-thiophen-2-yl-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-[3-(3,4-dichlorophenyl)-1,2-oxazol-5-yl]-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-[3-(3,4-dichlorophenyl)isoxazol-5-yl]-2-[[4-(2-thienyl)pyrimidin-2-yl]thio]ethanone Formula: C19H11Cl2N3O2S2 MolecularWeight: 448.34554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NC=C2)SCC(=O)C3=CC(=NO3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NC=C2)SCC(=O)C3=CC(=NO3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C19H11Cl2N3O2S2/c20-12-4-3-11(8-13(12)21)15-9-17(26-24-15)16(25)10-28-19-22-6-5-14(23-19)18-2-1-7-27-18/h1-9H,10H2