3-[1-[[2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[[2-[(4-methoxyphenyl)amino]-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[[2-(4-methoxyanilino)thiazol-4-yl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one CAS Name: 3-[1-[[2-(4-methoxyanilino)-4-thiazolyl]methyl]-4-piperidin-1-iumyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[[2-(4-methoxyanilino)-1,3-thiazol-4-yl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[[2-(p-anisidino)thiazol-4-yl]methyl]piperidin-1-ium-4-yl]-1H-benzimidazol-2-one Formula: C23H26N5O2S+ MolecularWeight: 436.54984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=CS2)C[NH+]3CCC(CC3)N4C5=CC=CC=C5NC4=O

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=CS2)C[NH+]3CCC(CC3)N4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C23H25N5O2S/c1-30-19-8-6-16(7-9-19)24-22-25-17(15-31-22)14-27-12-10-18(11-13-27)28-21-5-3-2-4-20(21)26-23(28)29/h2-9,15,18H,10-14H2,1H3,(H,24,25)(H,26,29)/p+1