3-[[5-[2-(4-oxidanylidenequinazolin-3-yl)ethanoylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-propanamide

Systemtic Name: 3-[[5-[2-(4-oxidanylidenequinazolin-3-yl)ethanoylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: 3-[[5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-propanamide CAS Name: 3-[[5-[[1-oxo-2-(4-oxo-3-quinazolinyl)ethyl]amino]-1,3,4-thiadiazol-2-yl]thio]-N-phenylpropanamide IUPAC Name: 3-[[5-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenylpropanamide Traditional Name: 3-[[5-[[2-(4-ketoquinazolin-3-yl)acetyl]amino]-1,3,4-thiadiazol-2-yl]thio]-N-phenyl-propionamide Formula: C21H18N6O3S2 MolecularWeight: 466.53602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCSC2=NN=C(S2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCSC2=NN=C(S2)NC(=O)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H18N6O3S2/c28-17(23-14-6-2-1-3-7-14)10-11-31-21-26-25-20(32-21)24-18(29)12-27-13-22-16-9-5-4-8-15(16)19(27)30/h1-9,13H,10-12H2,(H,23,28)(H,24,25,29)