5-(4-chlorophenyl)-3-(4-morpholin-4-ylbut-2-ynyl)-1,3,4-thiadiazol-2-one

Systemtic Name: 5-(4-chlorophenyl)-3-(4-morpholin-4-ylbut-2-ynyl)-1,3,4-thiadiazol-2-one Openeye Name: 5-(4-chlorophenyl)-3-(4-morpholinobut-2-ynyl)-1,3,4-thiadiazol-2-one CAS Name: 5-(4-chlorophenyl)-3-[4-(4-morpholinyl)but-2-ynyl]-1,3,4-thiadiazol-2-one IUPAC Name: 5-(4-chlorophenyl)-3-(4-morpholin-4-ylbut-2-ynyl)-1,3,4-thiadiazol-2-one Traditional Name: 5-(4-chlorophenyl)-3-(4-morpholinobut-2-ynyl)-1,3,4-thiadiazol-2-one Formula: C16H16ClN3O2S MolecularWeight: 349.83514

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC#CCN2C(=O)SC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1COCCN1CC#CCN2C(=O)SC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H16ClN3O2S/c17-14-5-3-13(4-6-14)15-18-20(16(21)23-15)8-2-1-7-19-9-11-22-12-10-19/h3-6H,7-12H2