(4-methylpiperazin-4-ium-1-yl)-(2-naphthalen-1-ylsulfanylphenyl)methanone

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-(2-naphthalen-1-ylsulfanylphenyl)methanone Openeye Name: (4-methylpiperazin-4-ium-1-yl)-[2-(1-naphthylsulfanyl)phenyl]methanone CAS Name: (4-methyl-1-piperazin-4-iumyl)-[2-(1-naphthalenylthio)phenyl]methanone IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-(2-naphthalen-1-ylsulfanylphenyl)methanone Traditional Name: (4-methylpiperazin-4-ium-1-yl)-[2-(1-naphthylthio)phenyl]methanone Formula: C22H23N2OS+ MolecularWeight: 363.49582

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2SC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2SC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H22N2OS/c1-23-13-15-24(16-14-23)22(25)19-10-4-5-11-21(19)26-20-12-6-8-17-7-2-3-9-18(17)20/h2-12H,13-16H2,1H3/p+1