4-methoxy-3-[[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]benzaldehyde

Systemtic Name: 4-methoxy-3-[[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]benzaldehyde Openeye Name: 4-methoxy-3-[[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]benzaldehyde CAS Name: 4-methoxy-3-[[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]methyl]benzaldehyde IUPAC Name: 4-methoxy-3-[[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]benzaldehyde Traditional Name: 3-[[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]methyl]-4-methoxy-benzaldehyde Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC(=C3)C=O)OC

Isomeric SMILES

COCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC(=C3)C=O)OC

InChI

InChI=1S/C21H22N2O4S/c1-26-11-5-10-23-20(25)17-6-3-4-7-18(17)22-21(23)28-14-16-12-15(13-24)8-9-19(16)27-2/h3-4,6-9,12-13H,5,10-11,14H2,1-2H3