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

Systemtic Name: 2-[4-oxidanylidene-3-(pyridin-3-ylmethyl)quinazolin-2-yl]sulfanyl-N-[phenyl(thiophen-2-yl)methyl]ethanamide Openeye Name: 2-[4-oxo-3-(3-pyridylmethyl)quinazolin-2-yl]sulfanyl-N-[phenyl(2-thienyl)methyl]acetamide CAS Name: 2-[[4-oxo-3-(3-pyridinylmethyl)-2-quinazolinyl]thio]-N-[phenyl(thiophen-2-yl)methyl]acetamide IUPAC Name: 2-[4-oxo-3-(pyridin-3-ylmethyl)quinazolin-2-yl]sulfanyl-N-[phenyl(thiophen-2-yl)methyl]acetamide Traditional Name: 2-[[4-keto-3-(3-pyridylmethyl)quinazolin-2-yl]thio]-N-[phenyl(2-thienyl)methyl]acetamide Formula: C27H22N4O2S2 MolecularWeight: 498.61918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CN=CC=C5

InChI

InChI=1S/C27H22N4O2S2/c32-24(30-25(23-13-7-15-34-23)20-9-2-1-3-10-20)18-35-27-29-22-12-5-4-11-21(22)26(33)31(27)17-19-8-6-14-28-16-19/h1-16,25H,17-18H2,(H,30,32)