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

Systemtic Name: 3-(4-oxidanylidenequinazolin-3-yl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(4-oxoquinazolin-3-yl)propanamide CAS Name: 3-(4-oxo-3-quinazolinyl)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-(4-ketoquinazolin-3-yl)propionamide Formula: C20H17N5O2S2 MolecularWeight: 423.51128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C20H17N5O2S2/c26-17(10-11-25-13-21-16-9-5-4-8-15(16)18(25)27)22-19-23-24-20(29-19)28-12-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,22,23,26)