propyl 3-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: propyl 3-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate Openeye Name: propyl 3-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoate CAS Name: 3-[[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]propanoic acid propyl ester IUPAC Name: propyl 3-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate Traditional Name: 3-[[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]propionic acid propyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCSC1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCCOC(=O)CCSC1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H24N2O3S/c1-4-12-27-20(25)11-13-28-22-23-19-8-6-5-7-18(19)21(26)24(22)17-10-9-15(2)16(3)14-17/h5-10,14H,4,11-13H2,1-3H3