(2R)-2-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-yl]sulfanyl-N-naphthalen-1-yl-propanamide

Systemtic Name: (2R)-2-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-yl]sulfanyl-N-naphthalen-1-yl-propanamide Openeye Name: (2R)-2-[[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]sulfanyl]-N-(1-naphthyl)propanamide CAS Name: (2R)-2-[[5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridinyl]thio]-N-(1-naphthalenyl)propanamide IUPAC Name: (2R)-2-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-yl]sulfanyl-N-naphthalen-1-ylpropanamide Traditional Name: (2R)-2-[[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]thio]-N-(1-naphthyl)propionamide Formula: C23H27N4O3S2+ MolecularWeight: 471.61548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC=C(C=C3)S(=O)(=O)N4CC[NH+](CC4)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NC=C(C=C3)S(=O)(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C23H26N4O3S2/c1-17(23(28)25-21-9-5-7-18-6-3-4-8-20(18)21)31-22-11-10-19(16-24-22)32(29,30)27-14-12-26(2)13-15-27/h3-11,16-17H,12-15H2,1-2H3,(H,25,28)/p+1/t17-/m1/s1