2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(1-benzylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(1-benzylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]-N-(1-benzylpiperidin-1-ium-4-yl)acetamide Formula: C25H31N4OS+ MolecularWeight: 435.60484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N4OS/c1-19-23(16-20-8-4-2-5-9-20)28-25(26-19)31-18-24(30)27-22-12-14-29(15-13-22)17-21-10-6-3-7-11-21/h2-11,22H,12-18H2,1H3,(H,26,28)(H,27,30)/p+1