1-[3-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2,4,6-trimethyl-phenyl]ethanone

Systemtic Name: 1-[3-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2,4,6-trimethyl-phenyl]ethanone Openeye Name: 1-[3-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2,4,6-trimethyl-phenyl]ethanone CAS Name: 1-[3-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2,4,6-trimethylphenyl]ethanone IUPAC Name: 1-[3-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2,4,6-trimethylphenyl]ethanone Traditional Name: 1-[3-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-2,4,6-trimethyl-phenyl]ethanone Formula: C14H17N3OS2 MolecularWeight: 307.43428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)CSC2=NN=C(S2)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)CSC2=NN=C(S2)N)C

InChI

InChI=1S/C14H17N3OS2/c1-7-5-8(2)12(10(4)18)9(3)11(7)6-19-14-17-16-13(15)20-14/h5H,6H2,1-4H3,(H2,15,16)