4-(4-oxidanylidenequinazolin-3-yl)-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 4-(4-oxidanylidenequinazolin-3-yl)-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: 4-(4-oxo-3-quinazolinyl)-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-(4-ketoquinazolin-3-yl)butyramide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19N5O2S/c27-18(23-21-25-24-19(29-21)13-15-7-2-1-3-8-15)11-6-12-26-14-22-17-10-5-4-9-16(17)20(26)28/h1-5,7-10,14H,6,11-13H2,(H,23,25,27)