ethyl 4-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: ethyl 4-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: ethyl 4-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]methyl]benzoic acid ethyl ester Formula: C18H16N2O2S2 MolecularWeight: 356.46184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CSC2=NN=C(S2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CSC2=NN=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O2S2/c1-2-22-17(21)15-10-8-13(9-11-15)12-23-18-20-19-16(24-18)14-6-4-3-5-7-14/h3-11H,2,12H2,1H3