5-[(3-bromophenyl)methylsulfanyl]-N-(oxolan-2-ylmethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(3-bromophenyl)methylsulfanyl]-N-(oxolan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-bromophenyl)methylsulfanyl]-N-(tetrahydrofuran-2-ylmethyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-bromophenyl)methylthio]-N-(2-oxolanylmethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-bromophenyl)methylsulfanyl]-N-(oxolan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-bromobenzyl)thio]-1,3,4-thiadiazol-2-yl]-(tetrahydrofurfuryl)amine Formula: C14H16BrN3OS2 MolecularWeight: 386.33034

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NN=C(S2)SCC3=CC(=CC=C3)Br

Isomeric SMILES

C1CC(OC1)CNC2=NN=C(S2)SCC3=CC(=CC=C3)Br

InChI

InChI=1S/C14H16BrN3OS2/c15-11-4-1-3-10(7-11)9-20-14-18-17-13(21-14)16-8-12-5-2-6-19-12/h1,3-4,7,12H,2,5-6,8-9H2,(H,16,17)