S-(methylamino) N-[1-(4-methoxy-1-methyl-piperazin-1-ium-1-yl)-2-phenyl-3-(sulfonylamino)cyclopropyl]carbonylcarbamothioate

Systemtic Name: S-(methylamino) N-[1-(4-methoxy-1-methyl-piperazin-1-ium-1-yl)-2-phenyl-3-(sulfonylamino)cyclopropyl]carbonylcarbamothioate Openeye Name: S-(methylamino) N-[1-(4-methoxy-1-methyl-piperazin-1-ium-1-yl)-2-phenyl-3-(sulfonylamino)cyclopropanecarbonyl]carbamothioate CAS Name: N-[[1-(4-methoxy-1-methyl-1-piperazin-1-iumyl)-2-phenyl-3-(sulfonylamino)cyclopropyl]-oxomethyl]carbamothioic acid S-(methylamino) ester IUPAC Name: S-(methylamino) N-[1-(4-methoxy-1-methylpiperazin-1-ium-1-yl)-2-phenyl-3-(sulfonylamino)cyclopropanecarbonyl]carbamothioate Traditional Name: N-[1-(4-methoxy-1-methyl-piperazin-1-ium-1-yl)-2-phenyl-3-(sulfonylamino)cyclopropanecarbonyl]thiocarbamic acid S-(methylamino) ester Formula: C18H26N5O5S2+ MolecularWeight: 456.55954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNSC(=O)NC(=O)C1(C(C1N=S(=O)=O)C2=CC=CC=C2)[N+]3(CCN(CC3)OC)C

Isomeric SMILES

CNSC(=O)NC(=O)C1(C(C1N=S(=O)=O)C2=CC=CC=C2)[N+]3(CCN(CC3)OC)C

InChI

InChI=1S/C18H25N5O5S2/c1-19-29-17(25)20-16(24)18(23(2)11-9-22(28-3)10-12-23)14(15(18)21-30(26)27)13-7-5-4-6-8-13/h4-8,14-15,19H,9-12H2,1-3H3/p+1