N-[[2-(4-ethanoylpiperazin-1-yl)-7-methoxy-quinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-3-methyl-thiophene-2-carboxamide

Systemtic Name: N-[[2-(4-ethanoylpiperazin-1-yl)-7-methoxy-quinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-3-methyl-thiophene-2-carboxamide Openeye Name: N-[[2-(4-acetylpiperazin-1-yl)-7-methoxy-quinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-3-methyl-thiophene-2-carboxamide CAS Name: N-[[2-(4-acetyl-1-piperazinyl)-7-methoxy-3-quinolin-1-iumyl]methyl]-N-(2-methoxyethyl)-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[[2-(4-acetylpiperazin-1-yl)-7-methoxyquinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-3-methylthiophene-2-carboxamide Traditional Name: N-[[2-(4-acetylpiperazino)-7-methoxy-quinolin-1-ium-3-yl]methyl]-N-(2-methoxyethyl)-3-methyl-thiophene-2-carboxamide Formula: C26H33N4O4S+ MolecularWeight: 497.62962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N(CCOC)CC2=C([NH+]=C3C=C(C=CC3=C2)OC)N4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=C(SC=C1)C(=O)N(CCOC)CC2=C([NH+]=C3C=C(C=CC3=C2)OC)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C26H32N4O4S/c1-18-7-14-35-24(18)26(32)30(12-13-33-3)17-21-15-20-5-6-22(34-4)16-23(20)27-25(21)29-10-8-28(9-11-29)19(2)31/h5-7,14-16H,8-13,17H2,1-4H3/p+1