N-[(2S)-3-methyl-1-oxidanylidene-1-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]butan-2-yl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[(2S)-3-methyl-1-oxidanylidene-1-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]butan-2-yl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[(1S)-2-methyl-1-[4-(2-thienylmethyl)piperazin-4-ium-1-carbonyl]propyl]-2-(1-naphthyl)acetamide CAS Name: N-[(2S)-3-methyl-1-oxo-1-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]butan-2-yl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[(2S)-3-methyl-1-oxo-1-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]butan-2-yl]-2-naphthalen-1-ylacetamide Traditional Name: N-[(1S)-2-methyl-1-[4-(2-thenyl)piperazin-4-ium-1-carbonyl]propyl]-2-(1-naphthyl)acetamide Formula: C26H32N3O2S+ MolecularWeight: 450.61618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC[NH+](CC1)CC2=CC=CS2)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CC[NH+](CC1)CC2=CC=CS2)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H31N3O2S/c1-19(2)25(26(31)29-14-12-28(13-15-29)18-22-10-6-16-32-22)27-24(30)17-21-9-5-8-20-7-3-4-11-23(20)21/h3-11,16,19,25H,12-15,17-18H2,1-2H3,(H,27,30)/p+1/t25-/m0/s1