2-[[5-[(2,6-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]cyclohexan-1-one

Systemtic Name: 2-[[5-[(2,6-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]cyclohexan-1-one Openeye Name: 2-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]cyclohexanone CAS Name: 2-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-1-cyclohexanone IUPAC Name: 2-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]cyclohexan-1-one Traditional Name: 2-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]cyclohexanone Formula: C16H19N3OS2 MolecularWeight: 333.47156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NN=C(S2)SC3CCCCC3=O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NN=C(S2)SC3CCCCC3=O

InChI

InChI=1S/C16H19N3OS2/c1-10-6-5-7-11(2)14(10)17-15-18-19-16(22-15)21-13-9-4-3-8-12(13)20/h5-7,13H,3-4,8-9H2,1-2H3,(H,17,18)