N-[(5-bromanylthiophen-3-yl)methyl]-2-methylsulfanyl-1,3-benzothiazol-6-amine

Systemtic Name: N-[(5-bromanylthiophen-3-yl)methyl]-2-methylsulfanyl-1,3-benzothiazol-6-amine Openeye Name: N-[(5-bromo-3-thienyl)methyl]-2-methylsulfanyl-1,3-benzothiazol-6-amine CAS Name: N-[(5-bromo-3-thiophenyl)methyl]-2-(methylthio)-1,3-benzothiazol-6-amine IUPAC Name: N-[(5-bromothiophen-3-yl)methyl]-2-methylsulfanyl-1,3-benzothiazol-6-amine Traditional Name: (5-bromo-3-thienyl)methyl-[2-(methylthio)-1,3-benzothiazol-6-yl]amine Formula: C13H11BrN2S3 MolecularWeight: 371.33884

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NCC3=CSC(=C3)Br

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NCC3=CSC(=C3)Br

InChI

InChI=1S/C13H11BrN2S3/c1-17-13-16-10-3-2-9(5-11(10)19-13)15-6-8-4-12(14)18-7-8/h2-5,7,15H,6H2,1H3