N-[5-methyl-3-(4-morpholin-4-ylbut-2-ynyl)-1,3,4-thiadiazol-2-ylidene]benzamide

Systemtic Name: N-[5-methyl-3-(4-morpholin-4-ylbut-2-ynyl)-1,3,4-thiadiazol-2-ylidene]benzamide Openeye Name: N-[5-methyl-3-(4-morpholinobut-2-ynyl)-1,3,4-thiadiazol-2-ylidene]benzamide CAS Name: N-[5-methyl-3-[4-(4-morpholinyl)but-2-ynyl]-1,3,4-thiadiazol-2-ylidene]benzamide IUPAC Name: N-[5-methyl-3-(4-morpholin-4-ylbut-2-ynyl)-1,3,4-thiadiazol-2-ylidene]benzamide Traditional Name: N-[5-methyl-3-(4-morpholinobut-2-ynyl)-1,3,4-thiadiazol-2-ylidene]benzamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=NC(=O)C2=CC=CC=C2)S1)CC#CCN3CCOCC3

Isomeric SMILES

CC1=NN(C(=NC(=O)C2=CC=CC=C2)S1)CC#CCN3CCOCC3

InChI

InChI=1S/C18H20N4O2S/c1-15-20-22(10-6-5-9-21-11-13-24-14-12-21)18(25-15)19-17(23)16-7-3-2-4-8-16/h2-4,7-8H,9-14H2,1H3