2-(cyanomethyl)-8-methyl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole-7-carboxylate

Systemtic Name: 2-(cyanomethyl)-8-methyl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole-7-carboxylate Openeye Name: 2-(cyanomethyl)-8-methyl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole-7-carboxylate CAS Name: 2-(cyanomethyl)-8-methyl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole-7-carboxylate IUPAC Name: 2-(cyanomethyl)-8-methyl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole-7-carboxylate Traditional Name: 2-(cyanomethyl)-8-methyl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole-7-carboxylate Formula: C13H9N2O3S- MolecularWeight: 273.28716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C3=C(CC2)SC(=N3)CC#N)C(=O)[O-]

Isomeric SMILES

CC1=C(OC2=C1C3=C(CC2)SC(=N3)CC#N)C(=O)[O-]

InChI

InChI=1S/C13H10N2O3S/c1-6-10-7(18-12(6)13(16)17)2-3-8-11(10)15-9(19-8)4-5-14/h2-4H2,1H3,(H,16,17)/p-1