[2-(phenylmethyl)-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]thiazin-6-yl] methanesulfonate

Systemtic Name: [2-(phenylmethyl)-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]thiazin-6-yl] methanesulfonate Openeye Name: (2-benzyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]thiazin-6-yl) methanesulfonate CAS Name: methanesulfonic acid [2-(phenylmethyl)-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]thiazin-6-yl] ester IUPAC Name: (2-benzyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]thiazin-6-yl) methanesulfonate Traditional Name: methanesulfonic acid (2-benzyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]thiazin-6-yl) ester Formula: C13H15N3O3S2 MolecularWeight: 325.4065

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CN2C(=NC(=N2)CC3=CC=CC=C3)SC1

Isomeric SMILES

CS(=O)(=O)OC1CN2C(=NC(=N2)CC3=CC=CC=C3)SC1

InChI

InChI=1S/C13H15N3O3S2/c1-21(17,18)19-11-8-16-13(20-9-11)14-12(15-16)7-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3