(2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3-morpholin-4-ium-4-yl-propan-2-ol

Systemtic Name: (2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3-morpholin-4-ium-4-yl-propan-2-ol Openeye Name: (2S)-1-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-3-morpholin-4-ium-4-yl-propan-2-ol CAS Name: (2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-3-(4-morpholin-4-iumyl)-2-propanol IUPAC Name: (2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3-morpholin-4-ium-4-ylpropan-2-ol Traditional Name: (2S)-1-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-3-morpholin-4-ium-4-yl-propan-2-ol Formula: C15H23N4O2S2+ MolecularWeight: 355.49872

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(C[NH+]2CCOCC2)O)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SC[C@H](C[NH+]2CCOCC2)O)C3=CC=CS3

InChI

InChI=1S/C15H22N4O2S2/c1-2-19-14(13-4-3-9-22-13)16-17-15(19)23-11-12(20)10-18-5-7-21-8-6-18/h3-4,9,12,20H,2,5-8,10-11H2,1H3/p+1/t12-/m0/s1