N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[4-(4-fluorophenyl)-5-methyl-thiazol-2-yl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[4-(4-fluorophenyl)-5-methyl-2-thiazolyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[4-(4-fluorophenyl)-5-methyl-thiazol-2-yl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H17FN4O2S2 MolecularWeight: 452.524383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN4O2S2/c1-3-10-27-20(29)16-9-6-14(11-17(16)24-22(27)30)19(28)26-21-25-18(12(2)31-21)13-4-7-15(23)8-5-13/h3-9,11H,1,10H2,2H3,(H,24,30)(H,25,26,28)