dimethyl-[2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioylamino]ethyl]azanium Openeye Name: dimethyl-[2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioylamino]ethyl]ammonium CAS Name: dimethyl-[2-[[[4-(1-pyrrolidinylsulfonyl)anilino]-sulfanylidenemethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioylamino]ethyl]azanium Traditional Name: dimethyl-[2-[(4-pyrrolidinosulfonylphenyl)thiocarbamoylamino]ethyl]ammonium Formula: C15H25N4O2S2+ MolecularWeight: 357.5146

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

C[NH+](C)CCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C15H24N4O2S2/c1-18(2)12-9-16-15(22)17-13-5-7-14(8-6-13)23(20,21)19-10-3-4-11-19/h5-8H,3-4,9-12H2,1-2H3,(H2,16,17,22)/p+1