5-(cyclohexylmethylsulfanyl)-N-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(cyclohexylmethylsulfanyl)-N-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(cyclohexylmethylsulfanyl)-N-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(cyclohexylmethylthio)-N-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(cyclohexylmethylsulfanyl)-N-(3,4-dimethylphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(cyclohexylmethylthio)-1,3,4-thiadiazol-2-yl]-(3,4-dimethylphenyl)amine Formula: C17H23N3S2 MolecularWeight: 333.51462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NN=C(S2)SCC3CCCCC3)C

InChI

InChI=1S/C17H23N3S2/c1-12-8-9-15(10-13(12)2)18-16-19-20-17(22-16)21-11-14-6-4-3-5-7-14/h8-10,14H,3-7,11H2,1-2H3,(H,18,19)