5-[(4-chloranyl-2,5-dimethyl-phenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(4-chloranyl-2,5-dimethyl-phenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(4-chloro-2,5-dimethyl-phenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[[(4-chloro-2,5-dimethylphenyl)thio]methyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(4-chloro-2,5-dimethylphenyl)sulfanylmethyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[[(4-chloro-2,5-dimethyl-phenyl)thio]methyl]-1,3,4-thiadiazol-2-yl]amine Formula: C11H12ClN3S2 MolecularWeight: 285.81608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)SCC2=NN=C(S2)N

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)SCC2=NN=C(S2)N

InChI

InChI=1S/C11H12ClN3S2/c1-6-4-9(7(2)3-8(6)12)16-5-10-14-15-11(13)17-10/h3-4H,5H2,1-2H3,(H2,13,15)