2-[(4-butan-2-ylphenyl)methylsulfanyl]-5-butylsulfanyl-1,3,4-thiadiazole

Systemtic Name: 2-[(4-butan-2-ylphenyl)methylsulfanyl]-5-butylsulfanyl-1,3,4-thiadiazole Openeye Name: 2-butylsulfanyl-5-[(4-sec-butylphenyl)methylsulfanyl]-1,3,4-thiadiazole CAS Name: 2-[(4-butan-2-ylphenyl)methylthio]-5-(butylthio)-1,3,4-thiadiazole IUPAC Name: 2-[(4-butan-2-ylphenyl)methylsulfanyl]-5-butylsulfanyl-1,3,4-thiadiazole Traditional Name: 2-(butylthio)-5-[(4-sec-butylbenzyl)thio]-1,3,4-thiadiazole Formula: C17H24N2S3 MolecularWeight: 352.58086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)SCC2=CC=C(C=C2)C(C)CC

Isomeric SMILES

CCCCSC1=NN=C(S1)SCC2=CC=C(C=C2)C(C)CC

InChI

InChI=1S/C17H24N2S3/c1-4-6-11-20-16-18-19-17(22-16)21-12-14-7-9-15(10-8-14)13(3)5-2/h7-10,13H,4-6,11-12H2,1-3H3