1-(1,3-benzothiazol-2-yl)-2-(4-bromanylthiophen-2-yl)ethanamine

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-2-(4-bromanylthiophen-2-yl)ethanamine Openeye Name: 1-(1,3-benzothiazol-2-yl)-2-(4-bromo-2-thienyl)ethanamine CAS Name: 1-(1,3-benzothiazol-2-yl)-2-(4-bromo-2-thiophenyl)ethanamine IUPAC Name: 1-(1,3-benzothiazol-2-yl)-2-(4-bromothiophen-2-yl)ethanamine Traditional Name: [1-(1,3-benzothiazol-2-yl)-2-(4-bromo-2-thienyl)ethyl]amine Formula: C13H11BrN2S2 MolecularWeight: 339.27384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(CC3=CC(=CS3)Br)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(CC3=CC(=CS3)Br)N

InChI

InChI=1S/C13H11BrN2S2/c14-8-5-9(17-7-8)6-10(15)13-16-11-3-1-2-4-12(11)18-13/h1-5,7,10H,6,15H2