4-methoxy-N-[2-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanylethanoyl]benzamide

Systemtic Name: 4-methoxy-N-[2-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanylethanoyl]benzamide Openeye Name: 4-methoxy-N-[2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanylacetyl]benzamide CAS Name: 4-methoxy-N-[1-oxo-2-[[4-oxo-3-(3-phenylpropyl)-2-quinazolinyl]thio]ethyl]benzamide IUPAC Name: 4-methoxy-N-[2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanylacetyl]benzamide Traditional Name: N-[2-[[4-keto-3-(3-phenylpropyl)quinazolin-2-yl]thio]acetyl]-4-methoxy-benzamide Formula: C27H25N3O4S MolecularWeight: 487.5701

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O4S/c1-34-21-15-13-20(14-16-21)25(32)29-24(31)18-35-27-28-23-12-6-5-11-22(23)26(33)30(27)17-7-10-19-8-3-2-4-9-19/h2-6,8-9,11-16H,7,10,17-18H2,1H3,(H,29,31,32)