2-(4,5-dihydro-1H-imidazol-2-yl)-4,7-dimethyl-1,4-benzothiazine; ethanedioic acid

Systemtic Name: 2-(4,5-dihydro-1H-imidazol-2-yl)-4,7-dimethyl-1,4-benzothiazine; ethanedioic acid Openeye Name: 2-(4,5-dihydro-1H-imidazol-2-yl)-4,7-dimethyl-1,4-benzothiazine; oxalic acid CAS Name: 2-(4,5-dihydro-1H-imidazol-2-yl)-4,7-dimethyl-1,4-benzothiazine; oxalic acid IUPAC Name: 2-(4,5-dihydro-1H-imidazol-2-yl)-4,7-dimethyl-1,4-benzothiazine; oxalic acid Traditional Name: 2-(2-imidazolin-2-yl)-4,7-dimethyl-1,4-benzothiazine; oxalic acid Formula: C15H17N3O4S MolecularWeight: 335.37818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C=C(S2)C3=NCCN3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C=C(S2)C3=NCCN3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H15N3S.C2H2O4/c1-9-3-4-10-11(7-9)17-12(8-16(10)2)13-14-5-6-15-13;3-1(4)2(5)6/h3-4,7-8H,5-6H2,1-2H3,(H,14,15);(H,3,4)(H,5,6)