1-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-2-yl]-2,3-dihydroindole-5-sulfonic acid

Systemtic Name: 1-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-2-yl]-2,3-dihydroindole-5-sulfonic acid Openeye Name: 1-[5-(dimethylcarbamoyl)-4-methyl-thiazol-2-yl]indoline-5-sulfonic acid CAS Name: 1-[5-[dimethylamino(oxo)methyl]-4-methyl-2-thiazolyl]-2,3-dihydroindole-5-sulfonic acid IUPAC Name: 1-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-2-yl]-2,3-dihydroindole-5-sulfonic acid Traditional Name: 1-[5-(dimethylcarbamoyl)-4-methyl-thiazol-2-yl]indoline-5-sulfonic acid Formula: C15H17N3O4S2 MolecularWeight: 367.44318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2CCC3=C2C=CC(=C3)S(=O)(=O)O)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=N1)N2CCC3=C2C=CC(=C3)S(=O)(=O)O)C(=O)N(C)C

InChI

InChI=1S/C15H17N3O4S2/c1-9-13(14(19)17(2)3)23-15(16-9)18-7-6-10-8-11(24(20,21)22)4-5-12(10)18/h4-5,8H,6-7H2,1-3H3,(H,20,21,22)