2-(8-chloranylnaphthalen-1-yl)sulfanyl-N-(4-methylpiperazin-4-ium-1-yl)ethanamide

Systemtic Name: 2-(8-chloranylnaphthalen-1-yl)sulfanyl-N-(4-methylpiperazin-4-ium-1-yl)ethanamide Openeye Name: 2-[(8-chloro-1-naphthyl)sulfanyl]-N-(4-methylpiperazin-4-ium-1-yl)acetamide CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]-N-(4-methyl-1-piperazin-4-iumyl)acetamide IUPAC Name: 2-(8-chloronaphthalen-1-yl)sulfanyl-N-(4-methylpiperazin-4-ium-1-yl)acetamide Traditional Name: 2-[(8-chloro-1-naphthyl)thio]-N-(4-methylpiperazin-4-ium-1-yl)acetamide Formula: C17H21ClN3OS+ MolecularWeight: 350.88614

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

InChI

InChI=1S/C17H20ClN3OS/c1-20-8-10-21(11-9-20)19-16(22)12-23-15-7-3-5-13-4-2-6-14(18)17(13)15/h2-7H,8-12H2,1H3,(H,19,22)/p+1