N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[4-(3-fluoro-4-methoxyphenyl)-2-thiazolyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C21H17FN4O3S2 MolecularWeight: 456.513083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCN3C(=O)C4=CC=CC=C4NC3=S)F

InChI

InChI=1S/C21H17FN4O3S2/c1-29-17-7-6-12(10-14(17)22)16-11-31-20(23-16)25-18(27)8-9-26-19(28)13-4-2-3-5-15(13)24-21(26)30/h2-7,10-11H,8-9H2,1H3,(H,24,30)(H,23,25,27)