(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-methyl-5-(methylamino)isothiazole-4-carboxylate CAS Name: 3-methyl-5-(methylamino)-4-isothiazolecarboxylic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-(methylamino)isothiazole-4-carboxylic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C15H15BrN2O4S MolecularWeight: 399.2596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCC2=CC3=C(C=C2Br)OCCO3)NC

Isomeric SMILES

CC1=NSC(=C1C(=O)OCC2=CC3=C(C=C2Br)OCCO3)NC

InChI

InChI=1S/C15H15BrN2O4S/c1-8-13(14(17-2)23-18-8)15(19)22-7-9-5-11-12(6-10(9)16)21-4-3-20-11/h5-6,17H,3-4,7H2,1-2H3