[(1R)-2-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[4-[(4-methoxyphenyl)sulfonyl-methylamino]-1-oxobutyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[4-[(4-methoxyphenyl)sulfonyl-methylamino]butanoylamino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[4-[(4-methoxyphenyl)sulfonyl-methyl-amino]butanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C20H30N3O4S2+ MolecularWeight: 440.5999

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CCCN(C)S(=O)(=O)C1=CC=C(C=C1)OC)C2=CSC=C2

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=O)CCCN(C)S(=O)(=O)C1=CC=C(C=C1)OC)C2=CSC=C2

InChI

InChI=1S/C20H29N3O4S2/c1-22(2)19(16-11-13-28-15-16)14-21-20(24)6-5-12-23(3)29(25,26)18-9-7-17(27-4)8-10-18/h7-11,13,15,19H,5-6,12,14H2,1-4H3,(H,21,24)/p+1/t19-/m0/s1