(phenylmethyl) 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]ethanoate

Systemtic Name: (phenylmethyl) 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]ethanoate Openeye Name: benzyl 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,2,5-thiadiazol-3-yl]thio]acetic acid benzyl ester Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC=C(C1)C2=NSN=C2SCC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN1CCC=C(C1)C2=NSN=C2SCC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H19N3O2S2/c1-20-9-5-8-14(10-20)16-17(19-24-18-16)23-12-15(21)22-11-13-6-3-2-4-7-13/h2-4,6-8H,5,9-12H2,1H3