N-ethyl-2-[4-oxidanylidene-3-(pyridin-3-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenyl-propanamide

Systemtic Name: N-ethyl-2-[4-oxidanylidene-3-(pyridin-3-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenyl-propanamide Openeye Name: N-ethyl-2-[4-oxo-3-(3-pyridylmethyl)quinazolin-2-yl]sulfanyl-N-phenyl-propanamide CAS Name: N-ethyl-2-[[4-oxo-3-(3-pyridinylmethyl)-2-quinazolinyl]thio]-N-phenylpropanamide IUPAC Name: N-ethyl-2-[4-oxo-3-(pyridin-3-ylmethyl)quinazolin-2-yl]sulfanyl-N-phenylpropanamide Traditional Name: N-ethyl-2-[[4-keto-3-(3-pyridylmethyl)quinazolin-2-yl]thio]-N-phenyl-propionamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC4=CN=CC=C4

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC4=CN=CC=C4

InChI

InChI=1S/C25H24N4O2S/c1-3-28(20-11-5-4-6-12-20)23(30)18(2)32-25-27-22-14-8-7-13-21(22)24(31)29(25)17-19-10-9-15-26-16-19/h4-16,18H,3,17H2,1-2H3