3-[2,4-bis(chloranyl)-5-prop-2-ynylsulfanyl-phenyl]-5-tert-butyl-1,3,4-thiadiazol-2-one

Systemtic Name: 3-[2,4-bis(chloranyl)-5-prop-2-ynylsulfanyl-phenyl]-5-tert-butyl-1,3,4-thiadiazol-2-one Openeye Name: 5-tert-butyl-3-(2,4-dichloro-5-prop-2-ynylsulfanyl-phenyl)-1,3,4-thiadiazol-2-one CAS Name: 5-tert-butyl-3-[2,4-dichloro-5-(prop-2-ynylthio)phenyl]-1,3,4-thiadiazol-2-one IUPAC Name: 5-tert-butyl-3-(2,4-dichloro-5-prop-2-ynylsulfanylphenyl)-1,3,4-thiadiazol-2-one Traditional Name: 5-tert-butyl-3-[2,4-dichloro-5-(propargylthio)phenyl]-1,3,4-thiadiazol-2-one Formula: C15H14Cl2N2OS2 MolecularWeight: 373.32046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)S1)C2=CC(=C(C=C2Cl)Cl)SCC#C

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)S1)C2=CC(=C(C=C2Cl)Cl)SCC#C

InChI

InChI=1S/C15H14Cl2N2OS2/c1-5-6-21-12-8-11(9(16)7-10(12)17)19-14(20)22-13(18-19)15(2,3)4/h1,7-8H,6H2,2-4H3