ethyl 2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[(3-morpholinosulfonylbenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-morpholinosulfonylbenzoyl)amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H21N3O6S2 MolecularWeight: 475.53794

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(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H21N3O6S2/c1-2-30-20(26)15-6-7-17-18(13-15)31-21(22-17)23-19(25)14-4-3-5-16(12-14)32(27,28)24-8-10-29-11-9-24/h3-7,12-13H,2,8-11H2,1H3,(H,22,23,25)