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

Systemtic Name: 5-[(3-bromophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-bromophenyl)methylsulfanyl]-N-(2-furylmethyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-bromophenyl)methylthio]-N-(2-furanylmethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-bromophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-bromobenzyl)thio]-1,3,4-thiadiazol-2-yl]-(2-furfuryl)amine Formula: C14H12BrN3OS2 MolecularWeight: 382.29858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CSC2=NN=C(S2)NCC3=CC=CO3

Isomeric SMILES

C1=CC(=CC(=C1)Br)CSC2=NN=C(S2)NCC3=CC=CO3

InChI

InChI=1S/C14H12BrN3OS2/c15-11-4-1-3-10(7-11)9-20-14-18-17-13(21-14)16-8-12-5-2-6-19-12/h1-7H,8-9H2,(H,16,17)