ethyl 2-(1,3-benzothiazol-6-ylcarbonylamino)-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(1,3-benzothiazol-6-ylcarbonylamino)-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(1,3-benzothiazole-6-carbonylamino)-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzothiazole-6-carbonylamino)-5-ethylthiophene-3-carboxylate Traditional Name: 2-(1,3-benzothiazole-6-carbonylamino)-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H16N2O3S2 MolecularWeight: 360.45054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC3=C(C=C2)N=CS3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC3=C(C=C2)N=CS3)C(=O)OCC

InChI

InChI=1S/C17H16N2O3S2/c1-3-11-8-12(17(21)22-4-2)16(24-11)19-15(20)10-5-6-13-14(7-10)23-9-18-13/h5-9H,3-4H2,1-2H3,(H,19,20)