N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-(2,3-dimethylphenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-3-(2,3-dimethylphenyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-(2,3-dimethylphenyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-(2,3-dimethylphenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-3-(2,3-dimethylphenyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C25H22ClN3O4S MolecularWeight: 495.97788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC(=C(C=C4OC)OC)Cl)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC(=C(C=C4OC)OC)Cl)NC2=S)C

InChI

InChI=1S/C25H22ClN3O4S/c1-13-6-5-7-20(14(13)2)29-24(31)16-9-8-15(10-18(16)28-25(29)34)23(30)27-19-11-17(26)21(32-3)12-22(19)33-4/h5-12H,1-4H3,(H,27,30)(H,28,34)