methyl 2-[[4-(diethylamino)phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[[4-(diethylamino)phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[[4-(diethylamino)benzoyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[4-(diethylamino)phenyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(diethylamino)benzoyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[4-(diethylamino)benzoyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H21N3O3S/c1-4-23(5-2)15-9-6-13(7-10-15)18(24)22-20-21-16-11-8-14(19(25)26-3)12-17(16)27-20/h6-12H,4-5H2,1-3H3,(H,21,22,24)