[(1S)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: [(1S)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: [(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid [(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] ester IUPAC Name: [(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid [(1S)-1-(4-keto-1H-quinazolin-2-yl)ethyl] ester Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

C[C@@H](C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C19H16N4O4S/c1-11(17-20-14-5-3-2-4-13(14)19(25)22-17)26-16(24)7-6-15-21-18(23-27-15)12-8-9-28-10-12/h2-5,8-11H,6-7H2,1H3,(H,20,22,25)/t11-/m0/s1