N-[1-(2,5-dimethoxyphenyl)ethyl]-2-[4-oxidanylidene-3-(pyridin-3-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-2-[4-oxidanylidene-3-(pyridin-3-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-2-[4-oxo-3-(3-pyridylmethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-2-[[4-oxo-3-(3-pyridinylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-2-[4-oxo-3-(pyridin-3-ylmethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-[1-(2,5-dimethoxyphenyl)ethyl]-2-[[4-keto-3-(3-pyridylmethyl)quinazolin-2-yl]thio]acetamide Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OC)OC)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CN=CC=C4

Isomeric SMILES

CC(C1=C(C=CC(=C1)OC)OC)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CN=CC=C4

InChI

InChI=1S/C26H26N4O4S/c1-17(21-13-19(33-2)10-11-23(21)34-3)28-24(31)16-35-26-29-22-9-5-4-8-20(22)25(32)30(26)15-18-7-6-12-27-14-18/h4-14,17H,15-16H2,1-3H3,(H,28,31)