4-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]thiomorpholin-4-ium

Systemtic Name: 4-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]thiomorpholin-4-ium Openeye Name: 4-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]thiomorpholin-4-ium CAS Name: 4-[[2-ethylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl]thiomorpholin-4-ium IUPAC Name: 4-[[2-ethylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]thiomorpholin-4-ium Traditional Name: 4-[[2-esyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]thiomorpholin-4-ium Formula: C19H28N3O2S2+ MolecularWeight: 394.57452

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)C[NH+]3CCSCC3

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)C[NH+]3CCSCC3

InChI

InChI=1S/C19H27N3O2S2/c1-2-26(23,24)19-20-15-18(16-21-11-13-25-14-12-21)22(19)10-6-9-17-7-4-3-5-8-17/h3-5,7-8,15H,2,6,9-14,16H2,1H3/p+1