2-methoxy-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-5-sulfamoyl-benzamide

Systemtic Name: 2-methoxy-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]-5-sulfamoyl-benzamide Openeye Name: 2-methoxy-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-5-sulfamoyl-benzamide CAS Name: 2-methoxy-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]-5-sulfamoylbenzamide IUPAC Name: 2-methoxy-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]-5-sulfamoylbenzamide Traditional Name: 2-methoxy-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]-5-sulfamoyl-benzamide Formula: C18H24N3O4S2+ MolecularWeight: 410.53086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NCC(C2=CC=CS2)[NH+]3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NC[C@@H](C2=CC=CS2)[NH+]3CCCC3

InChI

InChI=1S/C18H23N3O4S2/c1-25-16-7-6-13(27(19,23)24)11-14(16)18(22)20-12-15(17-5-4-10-26-17)21-8-2-3-9-21/h4-7,10-11,15H,2-3,8-9,12H2,1H3,(H,20,22)(H2,19,23,24)/p+1/t15-/m0/s1