3-[3-[4-[bis(fluoranyl)methoxy]phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanamide

Systemtic Name: 3-[3-[4-[bis(fluoranyl)methoxy]phenyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanamide Openeye Name: 3-[3-[4-(difluoromethoxy)phenyl]-4-oxo-quinazolin-2-yl]sulfanylpropanamide CAS Name: 3-[[3-[4-(difluoromethoxy)phenyl]-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: 3-[3-[4-(difluoromethoxy)phenyl]-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: 3-[[3-[4-(difluoromethoxy)phenyl]-4-keto-quinazolin-2-yl]thio]propionamide Formula: C18H15F2N3O3S MolecularWeight: 391.391806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCC(=O)N)C3=CC=C(C=C3)OC(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCC(=O)N)C3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C18H15F2N3O3S/c19-17(20)26-12-7-5-11(6-8-12)23-16(25)13-3-1-2-4-14(13)22-18(23)27-10-9-15(21)24/h1-8,17H,9-10H2,(H2,21,24)