N-(1H-imidazol-2-ylmethyl)-N-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-5-phenyl-benzamide

Systemtic Name: N-(1H-imidazol-2-ylmethyl)-N-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-5-phenyl-benzamide Openeye Name: N-(1H-imidazol-2-ylmethyl)-N-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-5-phenyl-benzamide CAS Name: N-(1H-imidazol-2-ylmethyl)-N-methyl-3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-5-phenylbenzamide IUPAC Name: N-(1H-imidazol-2-ylmethyl)-N-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-5-phenylbenzamide Traditional Name: N-(1H-imidazol-2-ylmethyl)-N-methyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-5-phenyl-benzamide Formula: C23H28N5O3S+ MolecularWeight: 454.56512

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)C(=O)N(C)CC3=NC=CN3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)C(=O)N(C)CC3=NC=CN3)C4=CC=CC=C4

InChI

InChI=1S/C23H27N5O3S/c1-26-10-12-28(13-11-26)32(30,31)21-15-19(18-6-4-3-5-7-18)14-20(16-21)23(29)27(2)17-22-24-8-9-25-22/h3-9,14-16H,10-13,17H2,1-2H3,(H,24,25)/p+1