5-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-propan-2-yl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-propan-2-yl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylsulfanyl]-N-isopropyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methylthio]-N-propan-2-yl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-N-propan-2-yl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylthio]-1,3,4-thiadiazol-2-yl]-isopropyl-amine Formula: C16H17BrN4OS3 MolecularWeight: 457.43138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NN=C(S1)SCC2=CSC(=N2)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC(C)NC1=NN=C(S1)SCC2=CSC(=N2)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C16H17BrN4OS3/c1-9(2)18-15-20-21-16(25-15)24-8-11-7-23-14(19-11)12-6-10(17)4-5-13(12)22-3/h4-7,9H,8H2,1-3H3,(H,18,20)