4-[2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylethoxy]benzenecarbonitrile Openeye Name: 4-[2-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanylethoxy]benzonitrile CAS Name: 4-[2-[[4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]ethoxy]benzonitrile IUPAC Name: 4-[2-[4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylethoxy]benzonitrile Traditional Name: 4-[2-[[4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]ethoxy]benzonitrile Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=CC=CC=C3N=C2SCCOC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=CC=CC=C3N=C2SCCOC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H21N3O3S/c23-14-16-7-9-17(10-8-16)28-12-13-29-22-24-20-6-2-1-5-19(20)21(26)25(22)15-18-4-3-11-27-18/h1-2,5-10,18H,3-4,11-13,15H2