2-[[5-(3-morpholin-4-ylsulfonylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethylazanium

Systemtic Name: 2-[[5-(3-morpholin-4-ylsulfonylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethylazanium Openeye Name: 2-[[4-allyl-5-(3-morpholinosulfonylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethylammonium CAS Name: 2-[[5-[3-(4-morpholinylsulfonyl)phenyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]ethylammonium IUPAC Name: 2-[[5-(3-morpholin-4-ylsulfonylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethylazanium Traditional Name: 2-[[4-allyl-5-(3-morpholinosulfonylphenyl)-1,2,4-triazol-3-yl]thio]ethylammonium Formula: C17H24N5O3S2+ MolecularWeight: 410.53416

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC[NH3+])C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C=CCN1C(=NN=C1SCC[NH3+])C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H23N5O3S2/c1-2-7-22-16(19-20-17(22)26-12-6-18)14-4-3-5-15(13-14)27(23,24)21-8-10-25-11-9-21/h2-5,13H,1,6-12,18H2/p+1