N-cyclohexyl-3-methyl-5-(4-methylsulfonylphenyl)-1,3,4-thiadiazol-2-imine

Systemtic Name: N-cyclohexyl-3-methyl-5-(4-methylsulfonylphenyl)-1,3,4-thiadiazol-2-imine Openeye Name: N-cyclohexyl-3-methyl-5-(4-methylsulfonylphenyl)-1,3,4-thiadiazol-2-imine CAS Name: N-cyclohexyl-3-methyl-5-(4-methylsulfonylphenyl)-1,3,4-thiadiazol-2-imine IUPAC Name: N-cyclohexyl-3-methyl-5-(4-methylsulfonylphenyl)-1,3,4-thiadiazol-2-imine Traditional Name: cyclohexyl-[5-(4-mesylphenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amine Formula: C16H21N3O2S2 MolecularWeight: 351.48684

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2CCCCC2)SC(=N1)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CN1C(=NC2CCCCC2)SC(=N1)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C16H21N3O2S2/c1-19-16(17-13-6-4-3-5-7-13)22-15(18-19)12-8-10-14(11-9-12)23(2,20)21/h8-11,13H,3-7H2,1-2H3