ethyl 5-(4-methylphenyl)-2-phenyl-3H-1,3,4-thiadiazole-2-carboxylate

Systemtic Name: ethyl 5-(4-methylphenyl)-2-phenyl-3H-1,3,4-thiadiazole-2-carboxylate Openeye Name: ethyl 2-phenyl-5-(p-tolyl)-3H-1,3,4-thiadiazole-2-carboxylate CAS Name: 5-(4-methylphenyl)-2-phenyl-3H-1,3,4-thiadiazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-methylphenyl)-2-phenyl-3H-1,3,4-thiadiazole-2-carboxylate Traditional Name: 2-phenyl-5-(p-tolyl)-3H-1,3,4-thiadiazole-2-carboxylic acid ethyl ester Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(NN=C(S1)C2=CC=C(C=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(NN=C(S1)C2=CC=C(C=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2O2S/c1-3-22-17(21)18(15-7-5-4-6-8-15)20-19-16(23-18)14-11-9-13(2)10-12-14/h4-12,20H,3H2,1-2H3