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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-oxidanylidene-3-(thiophen-2-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-oxo-3-(2-thienylmethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[4-oxo-3-(thiophen-2-ylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-oxo-3-(thiophen-2-ylmethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-homoveratryl-2-[[4-keto-3-(2-thenyl)quinazolin-2-yl]thio]acetamide Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CS4)OC

InChI

InChI=1S/C25H25N3O4S2/c1-31-21-10-9-17(14-22(21)32-2)11-12-26-23(29)16-34-25-27-20-8-4-3-7-19(20)24(30)28(25)15-18-6-5-13-33-18/h3-10,13-14H,11-12,15-16H2,1-2H3,(H,26,29)