N-ethyl-N-(3-iodanylprop-2-ynyl)-1,3-benzothiazol-2-amine

Systemtic Name: N-ethyl-N-(3-iodanylprop-2-ynyl)-1,3-benzothiazol-2-amine Openeye Name: N-ethyl-N-(3-iodoprop-2-ynyl)-1,3-benzothiazol-2-amine CAS Name: N-ethyl-N-(3-iodoprop-2-ynyl)-1,3-benzothiazol-2-amine IUPAC Name: N-ethyl-N-(3-iodoprop-2-ynyl)-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-ethyl-(3-iodoprop-2-ynyl)amine Formula: C12H11IN2S MolecularWeight: 342.19861

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC#CI)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CCN(CC#CI)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C12H11IN2S/c1-2-15(9-5-8-13)12-14-10-6-3-4-7-11(10)16-12/h3-4,6-7H,2,9H2,1H3