N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-4-morpholinosulfonyl-benzamide CAS Name: N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-4-morpholinosulfonyl-benzamide Formula: C21H28N3O5S2+ MolecularWeight: 466.59412

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=CS4

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=CS4

InChI

InChI=1S/C21H27N3O5S2/c25-21(22-16-19(20-2-1-15-30-20)23-7-11-28-12-8-23)17-3-5-18(6-4-17)31(26,27)24-9-13-29-14-10-24/h1-6,15,19H,7-14,16H2,(H,22,25)/p+1/t19-/m0/s1