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

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 4-methyl-3-pyrrol-1-yl-benzoate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 4-methyl-3-pyrrol-1-yl-benzoate CAS Name: 4-methyl-3-(1-pyrrolyl)benzoic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 4-methyl-3-pyrrol-1-ylbenzoate Traditional Name: 4-methyl-3-pyrrol-1-yl-benzoic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C15H12ClN3O2S MolecularWeight: 333.79268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=C(SN=N2)Cl)N3C=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=C(SN=N2)Cl)N3C=CC=C3

InChI

InChI=1S/C15H12ClN3O2S/c1-10-4-5-11(8-13(10)19-6-2-3-7-19)15(20)21-9-12-14(16)22-18-17-12/h2-8H,9H2,1H3