N-[2-[4-[bis(fluoranyl)methoxy]phenyl]ethyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[2-[4-[bis(fluoranyl)methoxy]phenyl]ethyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[2-[4-(difluoromethoxy)phenyl]ethyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[2-[4-(difluoromethoxy)phenyl]ethyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[2-[4-(difluoromethoxy)phenyl]ethyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[2-[4-(difluoromethoxy)phenyl]ethyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C18H15F2N3O3S MolecularWeight: 391.391806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3)OC(F)F

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)C2=CC3=C(C=C2)C(=O)NC(=S)N3)OC(F)F

InChI

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