5-[(4-dodecylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(4-dodecylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(4-dodecylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(4-dodecylphenyl)methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(4-dodecylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(4-laurylbenzyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C21H33N3S2 MolecularWeight: 391.63682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)CSC2=NN=C(S2)N

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)CSC2=NN=C(S2)N

InChI

InChI=1S/C21H33N3S2/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)17-25-21-24-23-20(22)26-21/h13-16H,2-12,17H2,1H3,(H2,22,23)