(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 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 (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 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 (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)CCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)CCC3=NC(=NO3)C4=CSC=C4

InChI

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