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

Systemtic Name: 2-[4-[(3,5-dimethoxyphenyl)amino]quinazolin-2-yl]sulfanyl-N-(3-methylbutyl)ethanamide Openeye Name: 2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl-N-isopentyl-acetamide CAS Name: 2-[[4-(3,5-dimethoxyanilino)-2-quinazolinyl]thio]-N-(3-methylbutyl)acetamide IUPAC Name: 2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl-N-(3-methylbutyl)acetamide Traditional Name: 2-[[4-(3,5-dimethoxyanilino)quinazolin-2-yl]thio]-N-isoamyl-acetamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC(C)CCNC(=O)CSC1=NC2=CC=CC=C2C(=N1)NC3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C23H28N4O3S/c1-15(2)9-10-24-21(28)14-31-23-26-20-8-6-5-7-19(20)22(27-23)25-16-11-17(29-3)13-18(12-16)30-4/h5-8,11-13,15H,9-10,14H2,1-4H3,(H,24,28)(H,25,26,27)