2-(4-acetamidophenyl)sulfanyl-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]ethanamide

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]ethanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]acetamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-[(2R)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]acetamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]acetamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]acetamide Formula: C20H26N3O3S2+ MolecularWeight: 420.56874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)NCC(C2=CC=CS2)[NH+]3CCOCC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)NC[C@H](C2=CC=CS2)[NH+]3CCOCC3

InChI

InChI=1S/C20H25N3O3S2/c1-15(24)22-16-4-6-17(7-5-16)28-14-20(25)21-13-18(19-3-2-12-27-19)23-8-10-26-11-9-23/h2-7,12,18H,8-11,13-14H2,1H3,(H,21,25)(H,22,24)/p+1/t18-/m1/s1