5-bromanyl-N-(1-pyridin-4-ylethyl)-1,3-benzothiazol-2-amine

Systemtic Name: 5-bromanyl-N-(1-pyridin-4-ylethyl)-1,3-benzothiazol-2-amine Openeye Name: 5-bromo-N-[1-(4-pyridyl)ethyl]-1,3-benzothiazol-2-amine CAS Name: 5-bromo-N-(1-pyridin-4-ylethyl)-1,3-benzothiazol-2-amine IUPAC Name: 5-bromo-N-(1-pyridin-4-ylethyl)-1,3-benzothiazol-2-amine Traditional Name: (5-bromo-1,3-benzothiazol-2-yl)-[1-(4-pyridyl)ethyl]amine Formula: C14H12BrN3S MolecularWeight: 334.23418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)NC2=NC3=C(S2)C=CC(=C3)Br

Isomeric SMILES

CC(C1=CC=NC=C1)NC2=NC3=C(S2)C=CC(=C3)Br

InChI

InChI=1S/C14H12BrN3S/c1-9(10-4-6-16-7-5-10)17-14-18-12-8-11(15)2-3-13(12)19-14/h2-9H,1H3,(H,17,18)