ethyl (5Z)-4-(4-chlorophenyl)-5-phenacylidene-1,3,4-thiadiazole-2-carboxylate

Systemtic Name: ethyl (5Z)-4-(4-chlorophenyl)-5-phenacylidene-1,3,4-thiadiazole-2-carboxylate Openeye Name: ethyl (5Z)-4-(4-chlorophenyl)-5-phenacylidene-1,3,4-thiadiazole-2-carboxylate CAS Name: (5Z)-4-(4-chlorophenyl)-5-phenacylidene-1,3,4-thiadiazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-4-(4-chlorophenyl)-5-phenacylidene-1,3,4-thiadiazole-2-carboxylate Traditional Name: (5Z)-4-(4-chlorophenyl)-5-phenacylidene-1,3,4-thiadiazole-2-carboxylic acid ethyl ester Formula: C19H15ClN2O3S MolecularWeight: 386.852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15ClN2O3S/c1-2-25-19(24)18-21-22(15-10-8-14(20)9-11-15)17(26-18)12-16(23)13-6-4-3-5-7-13/h3-12H,2H2,1H3/b17-12-