N-(3-chloranyl-4-methoxy-phenyl)-3-[2-chloranyl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-[2-chloranyl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-[2-chloro-5-(trifluoromethyl)phenyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-[2-chloro-5-(trifluoromethyl)phenyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-[2-chloro-5-(trifluoromethyl)phenyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-[2-chloro-5-(trifluoromethyl)phenyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H14Cl2F3N3O3S MolecularWeight: 540.34177

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=C(C=CC(=C4)C(F)(F)F)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=C(C=CC(=C4)C(F)(F)F)Cl)Cl

InChI

InChI=1S/C23H14Cl2F3N3O3S/c1-34-19-7-4-13(10-16(19)25)29-20(32)11-2-5-14-17(8-11)30-22(35)31(21(14)33)18-9-12(23(26,27)28)3-6-15(18)24/h2-10H,1H3,(H,29,32)(H,30,35)