N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-thiophene-2-carboxamide hydrochloride

Systemtic Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitro-thiophene-2-carboxamide hydrochloride Openeye Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-5-nitro-thiophene-2-carboxamide hydrochloride CAS Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-5-nitro-2-thiophenecarboxamide hydrochloride IUPAC Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)-5-nitrothiophene-2-carboxamide hydrochloride Traditional Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-morpholinoethyl)-5-nitro-thiophene-2-carboxamide hydrochloride Formula: C20H23ClN4O6S2 MolecularWeight: 515.00282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)N(CCN3CCOCC3)C(=O)C4=CC=C(S4)[N+](=O)[O-].Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)N(CCN3CCOCC3)C(=O)C4=CC=C(S4)[N+](=O)[O-].Cl

InChI

InChI=1S/C20H22N4O6S2.ClH/c1-28-13-3-4-14(29-2)18-17(13)21-20(32-18)23(8-7-22-9-11-30-12-10-22)19(25)15-5-6-16(31-15)24(26)27;/h3-6H,7-12H2,1-2H3;1H