2-(1,3-benzodioxol-5-yl)-1-(1,3-benzothiazol-2-yl)ethanamine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-1-(1,3-benzothiazol-2-yl)ethanamine Openeye Name: 2-(1,3-benzodioxol-5-yl)-1-(1,3-benzothiazol-2-yl)ethanamine CAS Name: 2-(1,3-benzodioxol-5-yl)-1-(1,3-benzothiazol-2-yl)ethanamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-1-(1,3-benzothiazol-2-yl)ethanamine Traditional Name: [2-(1,3-benzodioxol-5-yl)-1-(1,3-benzothiazol-2-yl)ethyl]amine Formula: C16H14N2O2S MolecularWeight: 298.35956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC(C3=NC4=CC=CC=C4S3)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC(C3=NC4=CC=CC=C4S3)N

InChI

InChI=1S/C16H14N2O2S/c17-11(16-18-12-3-1-2-4-15(12)21-16)7-10-5-6-13-14(8-10)20-9-19-13/h1-6,8,11H,7,9,17H2