methyl 2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[4-(4-fluorophenyl)thiazol-2-yl]sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[[4-(4-fluorophenyl)-2-thiazolyl]thio]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[[4-(4-fluorophenyl)thiazol-2-yl]thio]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H14FN3O3S2 MolecularWeight: 427.471863

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CSC3=NC(=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CSC3=NC(=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H14FN3O3S2/c1-27-19(26)12-4-7-14-15(8-12)22-17(24-18(14)25)10-29-20-23-16(9-28-20)11-2-5-13(21)6-3-11/h2-9H,10H2,1H3,(H,22,24,25)