N-[2-[4-oxidanylidene-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanylethanoyl]-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2-[4-oxidanylidene-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanylethanoyl]-1H-pyrrole-2-carboxamide Openeye Name: N-[2-[4-oxo-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanylacetyl]-1H-pyrrole-2-carboxamide CAS Name: N-[1-oxo-2-[[4-oxo-3-(4-phenoxyphenyl)-2-quinazolinyl]thio]ethyl]-1H-pyrrole-2-carboxamide IUPAC Name: N-[2-[4-oxo-3-(4-phenoxyphenyl)quinazolin-2-yl]sulfanylacetyl]-1H-pyrrole-2-carboxamide Traditional Name: N-[2-[[4-keto-3-(4-phenoxyphenyl)quinazolin-2-yl]thio]acetyl]-1H-pyrrole-2-carboxamide Formula: C27H20N4O4S MolecularWeight: 496.5371

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N=C3SCC(=O)NC(=O)C5=CC=CN5

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N=C3SCC(=O)NC(=O)C5=CC=CN5

InChI

InChI=1S/C27H20N4O4S/c32-24(30-25(33)23-11-6-16-28-23)17-36-27-29-22-10-5-4-9-21(22)26(34)31(27)18-12-14-20(15-13-18)35-19-7-2-1-3-8-19/h1-16,28H,17H2,(H,30,32,33)