(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 4-(1,3-dithian-2-yl)benzoate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 4-(1,3-dithian-2-yl)benzoate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 4-(1,3-dithian-2-yl)benzoate CAS Name: 4-(1,3-dithian-2-yl)benzoic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 4-(1,3-dithian-2-yl)benzoate Traditional Name: 4-(1,3-dithian-2-yl)benzoic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C14H13ClN2O2S3 MolecularWeight: 372.91322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC3=C(SN=N3)Cl

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)C(=O)OCC3=C(SN=N3)Cl

InChI

InChI=1S/C14H13ClN2O2S3/c15-12-11(16-17-22-12)8-19-13(18)9-2-4-10(5-3-9)14-20-6-1-7-21-14/h2-5,14H,1,6-8H2