N-(1,3-benzothiazol-2-yl)-5-bromanyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-5-bromanyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-5-bromo-N-(tetrahydrofuran-2-ylmethyl)pyridine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-5-bromo-N-(2-oxolanylmethyl)-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-5-bromo-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-5-bromo-N-(tetrahydrofurfuryl)nicotinamide Formula: C18H16BrN3O2S MolecularWeight: 418.30754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

C1CC(OC1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C18H16BrN3O2S/c19-13-8-12(9-20-10-13)17(23)22(11-14-4-3-7-24-14)18-21-15-5-1-2-6-16(15)25-18/h1-2,5-6,8-10,14H,3-4,7,11H2