N-[(4-bromanylthiophen-2-yl)methyl]-2-methylsulfanyl-1,3-benzothiazol-6-amine

Systemtic Name: N-[(4-bromanylthiophen-2-yl)methyl]-2-methylsulfanyl-1,3-benzothiazol-6-amine Openeye Name: N-[(4-bromo-2-thienyl)methyl]-2-methylsulfanyl-1,3-benzothiazol-6-amine CAS Name: N-[(4-bromo-2-thiophenyl)methyl]-2-(methylthio)-1,3-benzothiazol-6-amine IUPAC Name: N-[(4-bromothiophen-2-yl)methyl]-2-methylsulfanyl-1,3-benzothiazol-6-amine Traditional Name: (4-bromo-2-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=CC(=CS3)Br

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NCC3=CC(=CS3)Br

InChI

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