N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-(6-fluorothiochroman-4-yl)-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-(6-fluorothiochroman-4-yl)-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C20H18FN3O2S2 MolecularWeight: 415.504223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S)C=C(C=C2)F

Isomeric SMILES

C1CSC2=C(C1NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S)C=C(C=C2)F

InChI

InChI=1S/C20H18FN3O2S2/c21-12-5-6-17-14(11-12)16(8-10-28-17)22-18(25)7-9-24-19(26)13-3-1-2-4-15(13)23-20(24)27/h1-6,11,16H,7-10H2,(H,22,25)(H,23,27)