N-[2-(4-methoxyphenyl)ethyl]-2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-2-(4-oxidanylidene-3-pyridin-3-yl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-2-[4-oxo-3-(3-pyridyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-2-[[4-oxo-3-(3-pyridinyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-2-(4-oxo-3-pyridin-3-ylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[[4-keto-3-(3-pyridyl)quinazolin-2-yl]thio]-N-[2-(4-methoxyphenyl)ethyl]acetamide Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CN=CC=C4

InChI

InChI=1S/C24H22N4O3S/c1-31-19-10-8-17(9-11-19)12-14-26-22(29)16-32-24-27-21-7-3-2-6-20(21)23(30)28(24)18-5-4-13-25-15-18/h2-11,13,15H,12,14,16H2,1H3,(H,26,29)