3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(5-methylpyrazin-2-yl)methyl]-5-phenyl-benzamide

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(5-methylpyrazin-2-yl)methyl]-5-phenyl-benzamide Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(5-methylpyrazin-2-yl)methyl]-5-phenyl-benzamide CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-[(5-methyl-2-pyrazinyl)methyl]-5-phenylbenzamide IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(5-methylpyrazin-2-yl)methyl]-5-phenylbenzamide Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(5-methylpyrazin-2-yl)methyl]-5-phenyl-benzamide Formula: C24H28N5O3S+ MolecularWeight: 466.57582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)CNC(=O)C2=CC(=CC(=C2)C3=CC=CC=C3)S(=O)(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CN=C(C=N1)CNC(=O)C2=CC(=CC(=C2)C3=CC=CC=C3)S(=O)(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C24H27N5O3S/c1-18-15-26-22(16-25-18)17-27-24(30)21-12-20(19-6-4-3-5-7-19)13-23(14-21)33(31,32)29-10-8-28(2)9-11-29/h3-7,12-16H,8-11,17H2,1-2H3,(H,27,30)/p+1