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

Systemtic Name: ethyl 2-[(3-bromanyl-4-methoxy-phenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C18H15BrN2O4S MolecularWeight: 435.2917

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrN2O4S/c1-3-25-17(23)11-4-6-13-15(9-11)26-18(20-13)21-16(22)10-5-7-14(24-2)12(19)8-10/h4-9H,3H2,1-2H3,(H,20,21,22)