5-[(2-methylphenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(2-methylphenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-(o-tolylmethylsulfanylmethyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[[(2-methylphenyl)methylthio]methyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(2-methylphenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[[(2-methylbenzyl)thio]methyl]-1,3,4-thiadiazol-2-yl]amine Formula: C11H13N3S2 MolecularWeight: 251.37102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC2=NN=C(S2)N

Isomeric SMILES

CC1=CC=CC=C1CSCC2=NN=C(S2)N

InChI

InChI=1S/C11H13N3S2/c1-8-4-2-3-5-9(8)6-15-7-10-13-14-11(12)16-10/h2-5H,6-7H2,1H3,(H2,12,14)