N-cyclohexyl-2-[4-[(3,5-dimethoxyphenyl)amino]quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[4-[(3,5-dimethoxyphenyl)amino]quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[[4-(3,5-dimethoxyanilino)-2-quinazolinyl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-cyclohexyl-2-[[4-(3,5-dimethoxyanilino)quinazolin-2-yl]thio]acetamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC(=NC3=CC=CC=C32)SCC(=O)NC4CCCCC4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC(=NC3=CC=CC=C32)SCC(=O)NC4CCCCC4)OC

InChI

InChI=1S/C24H28N4O3S/c1-30-18-12-17(13-19(14-18)31-2)26-23-20-10-6-7-11-21(20)27-24(28-23)32-15-22(29)25-16-8-4-3-5-9-16/h6-7,10-14,16H,3-5,8-9,15H2,1-2H3,(H,25,29)(H,26,27,28)