2-[4-oxidanylidene-3-(pyridin-4-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(pyridin-4-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[4-oxo-3-(4-pyridylmethyl)quinazolin-2-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[4-oxo-3-(pyridin-4-ylmethyl)-2-quinazolinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[4-oxo-3-(pyridin-4-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[4-keto-3-(4-pyridylmethyl)quinazolin-2-yl]thio]-N-phenethyl-acetamide Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22N4O2S/c29-22(26-15-12-18-6-2-1-3-7-18)17-31-24-27-21-9-5-4-8-20(21)23(30)28(24)16-19-10-13-25-14-11-19/h1-11,13-14H,12,15-17H2,(H,26,29)