2-bromanyl-N-[4-methoxy-7-[methyl(oxan-4-ylmethyl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide

Systemtic Name: 2-bromanyl-N-[4-methoxy-7-[methyl(oxan-4-ylmethyl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide Openeye Name: 2-bromo-N-[4-methoxy-7-[methyl(tetrahydropyran-4-ylmethyl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide CAS Name: 2-bromo-N-[4-methoxy-7-[methyl(4-oxanylmethyl)amino]-1,3-benzothiazol-2-yl]-4-pyridinecarboxamide IUPAC Name: 2-bromo-N-[4-methoxy-7-[methyl(oxan-4-ylmethyl)amino]-1,3-benzothiazol-2-yl]pyridine-4-carboxamide Traditional Name: 2-bromo-N-[4-methoxy-7-[methyl(tetrahydropyran-4-ylmethyl)amino]-1,3-benzothiazol-2-yl]isonicotinamide Formula: C21H23BrN4O3S MolecularWeight: 491.40132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCOCC1)C2=C3C(=C(C=C2)OC)N=C(S3)NC(=O)C4=CC(=NC=C4)Br

Isomeric SMILES

CN(CC1CCOCC1)C2=C3C(=C(C=C2)OC)N=C(S3)NC(=O)C4=CC(=NC=C4)Br

InChI

InChI=1S/C21H23BrN4O3S/c1-26(12-13-6-9-29-10-7-13)15-3-4-16(28-2)18-19(15)30-21(24-18)25-20(27)14-5-8-23-17(22)11-14/h3-5,8,11,13H,6-7,9-10,12H2,1-2H3,(H,24,25,27)