2-(1,3-benzodioxol-5-yl)-5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-1,3,4-oxadiazole

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-(1,3-benzodioxol-5-yl)-5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-(1,3-benzodioxol-5-yl)-5-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-1,3,4-oxadiazole IUPAC Name: 2-(1,3-benzodioxol-5-yl)-5-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-(1,3-benzodioxol-5-yl)-5-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-1,3,4-oxadiazole Formula: C20H15ClN4O3S MolecularWeight: 426.8761

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=NN=C(O2)C3=CC4=C(C=C3)OCO4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1CSC2=NN=C(O2)C3=CC4=C(C=C3)OCO4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C20H15ClN4O3S/c1-12-15(18(21)25(24-12)14-5-3-2-4-6-14)10-29-20-23-22-19(28-20)13-7-8-16-17(9-13)27-11-26-16/h2-9H,10-11H2,1H3