N-(3,4-diethoxyphenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3,4-diethoxyphenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3,4-diethoxyphenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(3,4-diethoxyphenyl)-2-[[4-(ethylamino)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(3,4-diethoxyphenyl)-2-[[4-(ethylamino)quinazolin-2-yl]thio]acetamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)NC3=CC(=C(C=C3)OCC)OCC

Isomeric SMILES

CCNC1=NC(=NC2=CC=CC=C21)SCC(=O)NC3=CC(=C(C=C3)OCC)OCC

InChI

InChI=1S/C22H26N4O3S/c1-4-23-21-16-9-7-8-10-17(16)25-22(26-21)30-14-20(27)24-15-11-12-18(28-5-2)19(13-15)29-6-3/h7-13H,4-6,14H2,1-3H3,(H,24,27)(H,23,25,26)