4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 4-[[(2S)-2-methyl-1-piperidyl]sulfonyl]-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 4-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]-N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-[(2S)-2-methylpiperidin-1-yl]sulfonyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]benzamide Traditional Name: 4-[(2S)-2-methylpiperidino]sulfonyl-N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]benzamide Formula: C23H32N3O4S2+ MolecularWeight: 478.64788

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(C3=CC=CS3)[NH+]4CCOCC4

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC[C@@H](C3=CC=CS3)[NH+]4CCOCC4

InChI

InChI=1S/C23H31N3O4S2/c1-18-5-2-3-11-26(18)32(28,29)20-9-7-19(8-10-20)23(27)24-17-21(22-6-4-16-31-22)25-12-14-30-15-13-25/h4,6-10,16,18,21H,2-3,5,11-15,17H2,1H3,(H,24,27)/p+1/t18-,21-/m0/s1