5-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(3-bromanyl-4-methoxy-phenyl)methylsulfanyl]-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-bromo-4-methoxy-phenyl)methylsulfanyl]-N-[2-(2-thienyl)ethyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-bromo-4-methoxyphenyl)methylthio]-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-bromo-4-methoxyphenyl)methylsulfanyl]-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-bromo-4-methoxy-benzyl)thio]-1,3,4-thiadiazol-2-yl]-[2-(2-thienyl)ethyl]amine Formula: C16H16BrN3OS3 MolecularWeight: 442.41674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=C(S2)NCCC3=CC=CS3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=C(S2)NCCC3=CC=CS3)Br

InChI

InChI=1S/C16H16BrN3OS3/c1-21-14-5-4-11(9-13(14)17)10-23-16-20-19-15(24-16)18-7-6-12-3-2-8-22-12/h2-5,8-9H,6-7,10H2,1H3,(H,18,19)