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

Systemtic Name: N-(3,4-diethoxyphenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(3,4-diethoxyphenyl)-2-[2-(morpholinomethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(3,4-diethoxyphenyl)-2-[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(3,4-diethoxyphenyl)-2-[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(3,4-diethoxyphenyl)-2-[[2-(morpholinomethyl)quinazolin-4-yl]thio]acetamide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)CN4CCOCC4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)CN4CCOCC4)OCC

InChI

InChI=1S/C25H30N4O4S/c1-3-32-21-10-9-18(15-22(21)33-4-2)26-24(30)17-34-25-19-7-5-6-8-20(19)27-23(28-25)16-29-11-13-31-14-12-29/h5-10,15H,3-4,11-14,16-17H2,1-2H3,(H,26,30)