(2-phenyl-5-propyl-1,3-thiazol-4-yl) methanesulfonate

Systemtic Name: (2-phenyl-5-propyl-1,3-thiazol-4-yl) methanesulfonate Openeye Name: (2-phenyl-5-propyl-thiazol-4-yl) methanesulfonate CAS Name: methanesulfonic acid (2-phenyl-5-propyl-4-thiazolyl) ester IUPAC Name: (2-phenyl-5-propyl-1,3-thiazol-4-yl) methanesulfonate Traditional Name: methanesulfonic acid (2-phenyl-5-propyl-thiazol-4-yl) ester Formula: C13H15NO3S2 MolecularWeight: 297.3931

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(S1)C2=CC=CC=C2)OS(=O)(=O)C

Isomeric SMILES

CCCC1=C(N=C(S1)C2=CC=CC=C2)OS(=O)(=O)C

InChI

InChI=1S/C13H15NO3S2/c1-3-7-11-12(17-19(2,15)16)14-13(18-11)10-8-5-4-6-9-10/h4-6,8-9H,3,7H2,1-2H3