3-[12-(2-azanylidene-5-thiophen-2-yl-1,3,4-thiadiazol-3-yl)dodecyl]-5-thiophen-2-yl-1,3,4-thiadiazol-2-imine bromide

Systemtic Name: 3-[12-(2-azanylidene-5-thiophen-2-yl-1,3,4-thiadiazol-3-yl)dodecyl]-5-thiophen-2-yl-1,3,4-thiadiazol-2-imine bromide Openeye Name: 3-[12-[2-imino-5-(2-thienyl)-1,3,4-thiadiazol-3-yl]dodecyl]-5-(2-thienyl)-1,3,4-thiadiazol-2-imine bromide CAS Name: 3-[12-(2-imino-5-thiophen-2-yl-1,3,4-thiadiazol-3-yl)dodecyl]-5-thiophen-2-yl-1,3,4-thiadiazol-2-imine bromide IUPAC Name: 3-[12-(2-imino-5-thiophen-2-yl-1,3,4-thiadiazol-3-yl)dodecyl]-5-thiophen-2-yl-1,3,4-thiadiazol-2-imine bromide Traditional Name: [3-[12-[2-imino-5-(2-thienyl)-1,3,4-thiadiazol-3-yl]dodecyl]-5-(2-thienyl)-1,3,4-thiadiazol-2-ylidene]amine bromide Formula: C24H32BrN6S4- MolecularWeight: 612.71508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NN(C(=N)S2)CCCCCCCCCCCCN3C(=N)SC(=N3)C4=CC=CS4.[Br-]

Isomeric SMILES

C1=CSC(=C1)C2=NN(C(=N)S2)CCCCCCCCCCCCN3C(=N)SC(=N3)C4=CC=CS4.[Br-]

InChI

InChI=1S/C24H32N6S4.BrH/c25-23-29(27-21(33-23)19-13-11-17-31-19)15-9-7-5-3-1-2-4-6-8-10-16-30-24(26)34-22(28-30)20-14-12-18-32-20;/h11-14,17-18,25-26H,1-10,15-16H2;1H/p-1