4,5-dihydro-1,3-thiazol-2-amine; 4-oxidanylidene-4-[(4-sulfamoylphenyl)amino]butanoic acid

Systemtic Name: 4,5-dihydro-1,3-thiazol-2-amine; 4-oxidanylidene-4-[(4-sulfamoylphenyl)amino]butanoic acid Openeye Name: 4,5-dihydrothiazol-2-amine; 4-oxo-4-(4-sulfamoylanilino)butanoic acid CAS Name: 4,5-dihydrothiazol-2-amine; 4-oxo-4-(4-sulfamoylanilino)butanoic acid IUPAC Name: 4,5-dihydro-1,3-thiazol-2-amine; 4-oxo-4-(4-sulfamoylanilino)butanoic acid Traditional Name: 4-keto-4-(4-sulfamoylanilino)butyric acid; 2-thiazolin-2-ylamine Formula: C13H18N4O5S2 MolecularWeight: 374.43582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=N1)N.C1=CC(=CC=C1NC(=O)CCC(=O)O)S(=O)(=O)N

Isomeric SMILES

C1CSC(=N1)N.C1=CC(=CC=C1NC(=O)CCC(=O)O)S(=O)(=O)N

InChI

InChI=1S/C10H12N2O5S.C3H6N2S/c11-18(16,17)8-3-1-7(2-4-8)12-9(13)5-6-10(14)15;4-3-5-1-2-6-3/h1-4H,5-6H2,(H,12,13)(H,14,15)(H2,11,16,17);1-2H2,(H2,4,5)