N-(5-octyl-1,3,4-thiadiazol-2-yl)-2-(4-oxidanylidenequinazolin-3-yl)ethanamide

Systemtic Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-2-(4-oxidanylidenequinazolin-3-yl)ethanamide Openeye Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-2-(4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: 2-(4-ketoquinazolin-3-yl)-N-(5-octyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C20H25N5O2S MolecularWeight: 399.5098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)NC(=O)CN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)NC(=O)CN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H25N5O2S/c1-2-3-4-5-6-7-12-18-23-24-20(28-18)22-17(26)13-25-14-21-16-11-9-8-10-15(16)19(25)27/h8-11,14H,2-7,12-13H2,1H3,(H,22,24,26)