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

Systemtic Name: 5-ethyl-N-(3-iodanylprop-2-ynyl)-1,3-benzothiazol-2-amine Openeye Name: 5-ethyl-N-(3-iodoprop-2-ynyl)-1,3-benzothiazol-2-amine CAS Name: 5-ethyl-N-(3-iodoprop-2-ynyl)-1,3-benzothiazol-2-amine IUPAC Name: 5-ethyl-N-(3-iodoprop-2-ynyl)-1,3-benzothiazol-2-amine Traditional Name: (5-ethyl-1,3-benzothiazol-2-yl)-(3-iodoprop-2-ynyl)amine Formula: C12H11IN2S MolecularWeight: 342.19861

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)SC(=N2)NCC#CI

Isomeric SMILES

CCC1=CC2=C(C=C1)SC(=N2)NCC#CI

InChI

InChI=1S/C12H11IN2S/c1-2-9-4-5-11-10(8-9)15-12(16-11)14-7-3-6-13/h4-5,8H,2,7H2,1H3,(H,14,15)