(5-methyl-4-phenyl-thiophen-3-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-methyl-4-phenyl-thiophen-3-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-methyl-4-phenyl-3-thienyl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (5-methyl-4-phenyl-3-thiophenyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-methyl-4-phenylthiophen-3-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-methyl-4-phenyl-3-thienyl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C17H21N2OS+ MolecularWeight: 301.42644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CS1)C(=O)N2CC[NH+](CC2)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CS1)C(=O)N2CC[NH+](CC2)C)C3=CC=CC=C3

InChI

InChI=1S/C17H20N2OS/c1-13-16(14-6-4-3-5-7-14)15(12-21-13)17(20)19-10-8-18(2)9-11-19/h3-7,12H,8-11H2,1-2H3/p+1