propan-2-yl 2-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: propan-2-yl 2-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: isopropyl 2-[(3-bromo-4-methoxy-benzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(3-bromo-4-methoxyphenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(3-bromo-4-methoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-bromo-4-methoxy-benzoyl)amino]-1,3-benzothiazole-6-carboxylic acid isopropyl ester Formula: C19H17BrN2O4S MolecularWeight: 449.31828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC(C)OC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C19H17BrN2O4S/c1-10(2)26-18(24)12-4-6-14-16(9-12)27-19(21-14)22-17(23)11-5-7-15(25-3)13(20)8-11/h4-10H,1-3H3,(H,21,22,23)