4-[2-[2-(2,3-dihydro-1-benzofuran-5-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[2-(2,3-dihydro-1-benzofuran-5-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-[2-(2,3-dihydrobenzofuran-5-yl)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[2-[[2-(2,3-dihydrobenzofuran-5-yl)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-[2-[2-(2,3-dihydro-1-benzofuran-5-yl)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 4-[2-[(2-coumaran-5-yl-2-keto-ethyl)thio]-4-keto-quinazolin-3-yl]benzonitrile Formula: C25H17N3O3S MolecularWeight: 439.48578

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

Isomeric SMILES

C1COC2=C1C=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

InChI

InChI=1S/C25H17N3O3S/c26-14-16-5-8-19(9-6-16)28-24(30)20-3-1-2-4-21(20)27-25(28)32-15-22(29)17-7-10-23-18(13-17)11-12-31-23/h1-10,13H,11-12,15H2