N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C20H20FN3O2S2 MolecularWeight: 417.520103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)F

InChI

InChI=1S/C20H20FN3O2S2/c21-16-7-3-1-5-14(16)13-28-12-10-22-18(25)9-11-24-19(26)15-6-2-4-8-17(15)23-20(24)27/h1-8H,9-13H2,(H,22,25)(H,23,27)