4-(1-methylpiperazin-1-ium-1-yl)-N-[(Z)-N'-methylsulfonylcarbamimidoyl]benzamide

Systemtic Name: 4-(1-methylpiperazin-1-ium-1-yl)-N-[(Z)-N'-methylsulfonylcarbamimidoyl]benzamide Openeye Name: 4-(1-methylpiperazin-1-ium-1-yl)-N-[(Z)-N'-methylsulfonylcarbamimidoyl]benzamide CAS Name: N-[(Z)-amino(methylsulfonylimino)methyl]-4-(1-methyl-1-piperazin-1-iumyl)benzamide IUPAC Name: 4-(1-methylpiperazin-1-ium-1-yl)-N-[(Z)-N'-methylsulfonylcarbamimidoyl]benzamide Traditional Name: N-[(Z)-N'-mesylamidino]-4-(1-methylpiperazin-1-ium-1-yl)benzamide Formula: C14H22N5O3S+ MolecularWeight: 340.42118

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)C2=CC=C(C=C2)C(=O)NC(=NS(=O)(=O)C)N

Isomeric SMILES

C[N+]1(CCNCC1)C2=CC=C(C=C2)C(=O)N/C(=N\S(=O)(=O)C)/N

InChI

InChI=1S/C14H21N5O3S/c1-19(9-7-16-8-10-19)12-5-3-11(4-6-12)13(20)17-14(15)18-23(2,21)22/h3-6,16H,7-10H2,1-2H3,(H2-,15,17,18,20)/p+1